Pennsylvania Pesticide Mixture 333 10 µg/mL in Acetonitrile
Product Code
DRE-A50000333AL
CAS Number
62 AnalytesProduct Format
Mixture
Solvent
Acetonitrile
Regulatory Method
Pennsylvania
Product Categories
Pesticides and growth regulators, Pesticide mixtures, Dr. Ehrenstorfer, Pesticide mixtures, Standards For Food Regulatory Methods
Product Type
Native/ParentDocumentation
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Product Information
Analyte Data
Analyte Name
Concentration
CAS Number
Molecular Structure
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Melting Point
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SMILES
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InChI
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IUPAC
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Abamectin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C48H72O14
Molecular Weight
873.08
Accurate Mass
872.49
SMILES
C/C([C@@H](O[C@]1(C[C@@H]([C@H]([C@@H](O1)C)O[C@]2(C[C@@H]([C@H]([C@@H](O2)C)O)OC)[H])OC)[H])[C@H](/C=C/C=C3CO[C@]4([C@@]\3([C@@]([H])(C=C([C@H]4O)C)C(O[C@H](C[C@]5(O6)O[C@]([C@@]([H])(C)CC)([C@H](C=C5)C)[H])C7)=O)O)[H])C)=C\C[C@]76[H]
InChI
InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12+,27-15+,32-14+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1
IUPAC
(2S,2a'E,2a1'S,4'E,5S,6R,6'S,7'S,8'E,11'R,15'S,17a'R,20'R,20a'R)-6-((S)-sec-butyl)-2a1',20'-dihydroxy-7'-(((2R,4S,5S,6S)-5-(((2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-5,6',8',19'-tetramethyl-2a1',5,6,6',7',10',11',14',15',17a',20',20a'-dodecahydro-2'H,17'H-spiro[pyran-2,13'-[11,15]methano[1,5]dioxacyclooctadecino[9,8,7-cd]benzofuran]-17'-one
Acephate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C4 H10 N O3 P S
Molecular Weight
183.17
Accurate Mass
183.0119
SMILES
COP(=O)(NC(=O)C)SC
InChI
InChI=1S/C4H10NO3PS/c1-4(6)5-9(7,8-2)10-3/h1-3H3,(H,5,6,7)
IUPAC
N-[methoxy(methylsulfanyl)phosphoryl]acetamide
Acequinocyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C24 H32 O4
Molecular Weight
384.51
Accurate Mass
384.2301
SMILES
CCCCCCCCCCCCC1=C(OC(=O)C)C(=O)c2ccccc2C1=O
InChI
InChI=1S/C24H32O4/c1-3-4-5-6-7-8-9-10-11-12-17-21-22(26)19-15-13-14-16-20(19)23(27)24(21)28-18(2)25/h13-16H,3-12,17H2,1-2H3
IUPAC
(3-dodecyl-1,4-dioxonaphthalen-2-yl) acetate
Acetamiprid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H11 Cl N4
Molecular Weight
222.67
Accurate Mass
222.0672
SMILES
CN(Cc1ccc(Cl)nc1)\C(=N\C#N)\C
InChI
InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3/b14-8+
IUPAC
N-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamide
Aldicarb
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H14 N2 O2 S
Molecular Weight
190.26
Accurate Mass
190.0776
SMILES
CNC(=O)ON=CC(C)(C)SC
InChI
InChI=1S/C7H14N2O2S/c1-7(2,12-4)5-9-11-6(10)8-3/h5H,1-4H3,(H,8,10)
IUPAC
[(2-methyl-2-methylsulfanylpropylidene)amino] N-methylcarbamate
Azoxystrobin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C22 H17 N3 O5
Molecular Weight
403.39
Accurate Mass
403.1168
SMILES
CO\C=C(\C(=O)OC)/c1ccccc1Oc2cc(Oc3ccccc3C#N)ncn2
InChI
InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+
IUPAC
methyl (E)-2-[2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxyphenyl]-3-methoxyprop-2-enoate
Bifenazate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C17 H20 N2 O3
Molecular Weight
300.35
Accurate Mass
300.1474
SMILES
COc1ccc(cc1NNC(=O)OC(C)C)c2ccccc2
InChI
InChI=1S/C17H20N2O3/c1-12(2)22-17(20)19-18-15-11-14(9-10-16(15)21-3)13-7-5-4-6-8-13/h4-12,18H,1-3H3,(H,19,20)
IUPAC
propan-2-yl N-(2-methoxy-5-phenylanilino)carbamate
Bifenthrin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C23 H22 Cl F3 O2
Molecular Weight
422.87
Accurate Mass
422.126
SMILES
Cc1c(COC(=O)[C@H]2[C@@H](\C=C(/Cl)\C(F)(F)F)C2(C)C)cccc1c3ccccc3
InChI
InChI=1S/C23H22ClF3O2/c1-14-16(10-7-11-17(14)15-8-5-4-6-9-15)13-29-21(28)20-18(22(20,2)3)12-19(24)23(25,26)27/h4-12,18,20H,13H2,1-3H3/b19-12-/t18-,20-/m1/s1
IUPAC
(2-methyl-3-phenylphenyl)methyl (1S,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
Boscalid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H12 Cl2 N2 O
Molecular Weight
343.21
Accurate Mass
342.0327
SMILES
Clc1ccc(cc1)c2ccccc2NC(=O)c3cccnc3Cl
InChI
InChI=1S/C18H12Cl2N2O/c19-13-9-7-12(8-10-13)14-4-1-2-6-16(14)22-18(23)15-5-3-11-21-17(15)20/h1-11H,(H,22,23)
IUPAC
2-chloro-N-[2-(4-chlorophenyl)phenyl]pyridine-3-carboxamide
Captan
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H8 Cl3 N O2 S
Molecular Weight
300.59
Accurate Mass
298.9341
SMILES
ClC(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O
InChI
InChI=1S/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2
IUPAC
2-(trichloromethylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Carbaryl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H11 N O2
Molecular Weight
201.22
Accurate Mass
201.079
SMILES
CNC(=O)Oc1cccc2ccccc12
InChI
InChI=1S/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)
IUPAC
naphthalen-1-yl N-methylcarbamate
Carbofuran
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H15 N O3
Molecular Weight
221.25
Accurate Mass
221.1052
SMILES
CNC(=O)Oc1cccc2CC(C)(C)Oc12
InChI
InChI=1S/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)
IUPAC
(2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate
Chlorantraniliprole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H14 Br Cl2 N5 O2
Molecular Weight
483.15
Accurate Mass
480.9708
SMILES
CNC(=O)c1cc(Cl)cc(C)c1NC(=O)c2cc(Br)nn2c3ncccc3Cl
InChI
InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28)
IUPAC
5-bromo-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-2-(3-chloropyridin-2-yl)pyrazole-3-carboxamide
Chlorfenapyr
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H11 Br Cl F3 N2 O
Molecular Weight
407.61
Accurate Mass
405.9695
SMILES
CCOCn1c(c2ccc(Cl)cc2)c(C#N)c(Br)c1C(F)(F)F
InChI
InChI=1S/C15H11BrClF3N2O/c1-2-23-8-22-13(9-3-5-10(17)6-4-9)11(7-21)12(16)14(22)15(18,19)20/h3-6H,2,8H2,1H3
IUPAC
4-bromo-2-(4-chlorophenyl)-1-(ethoxymethyl)-5-(trifluoromethyl)pyrrole-3-carbonitrile
Chlorpyrifos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H11 Cl3 N O3 P S
Molecular Weight
350.59
Accurate Mass
348.9263
SMILES
CCOP(=S)(OCC)Oc1nc(Cl)c(Cl)cc1Cl
InChI
InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3
IUPAC
diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxy-?^{5}-phosphane
Clofentezine
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H8 Cl2 N4
Molecular Weight
303.15
Accurate Mass
302.0126
SMILES
Clc1ccccc1c2nnc(nn2)c3ccccc3Cl
InChI
InChI=1S/C14H8Cl2N4/c15-11-7-3-1-5-9(11)13-17-19-14(20-18-13)10-6-2-4-8-12(10)16/h1-8H
IUPAC
3,6-bis(2-chlorophenyl)-1,2,4,5-tetrazine
Cyfluthrin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C22 H18 Cl2 F N O3
Molecular Weight
434.29
Accurate Mass
433.0648
SMILES
CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c2ccc(F)c(Oc3ccccc3)c2
InChI
InChI=1S/C22H18Cl2FNO3/c1-22(2)15(11-19(23)24)20(22)21(27)29-18(12-26)13-8-9-16(25)17(10-13)28-14-6-4-3-5-7-14/h3-11,15,18,20H,1-2H3
IUPAC
[cyano-(4-fluoro-3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Cypermethrin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C22 H19 Cl2 N O3
Molecular Weight
415.07
Accurate Mass
415.0742
SMILES
CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2
InChI
InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3
IUPAC
[cyano-(3-phenoxyphenyl)methyl] 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Daminozide
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H12 N2 O3
Molecular Weight
160.17
Accurate Mass
160.0848
SMILES
CN(C)NC(=O)CCC(=O)O
InChI
InChI=1S/C6H12N2O3/c1-8(2)7-5(9)3-4-6(10)11/h3-4H2,1-2H3,(H,7,9)(H,10,11)
IUPAC
4-(2,2-dimethylhydrazinyl)-4-oxobutanoic acid
Diazinon
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H21 N2 O3 P S
Molecular Weight
304.35
Accurate Mass
304.101
SMILES
CCOP(=S)(OCC)Oc1cc(C)nc(n1)C(C)C
InChI
InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3
IUPAC
diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-?^{5}-phosphane
Dichlorvos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C4 H7 Cl2 O4 P
Molecular Weight
220.98
Accurate Mass
219.9459
SMILES
COP(=O)(OC)OC=C(Cl)Cl
InChI
InChI=1S/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3
IUPAC
2,2-dichloroethenyl dimethyl phosphate
Dimethoate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 H12 N O3 P S2
Molecular Weight
229.26
Accurate Mass
228.9996
SMILES
CNC(=O)CSP(=S)(OC)OC
InChI
InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)
IUPAC
2-dimethoxyphosphinothioylsulfanyl-N-methylacetamide
Dimethomorph
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C21 H22 Cl N O4
Molecular Weight
387.86
Accurate Mass
387.1237
SMILES
COc1ccc(cc1OC)\C(=C\C(=O)N2CCOCC2)\c3ccc(Cl)cc3
InChI
InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+
IUPAC
(E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one
Ethoprophos
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C8 H19 O2 P S2
Molecular Weight
242.34
Accurate Mass
242.0564
SMILES
CCCSP(=O)(OCC)SCCC
InChI
InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3
IUPAC
1-[ethoxy(propylsulfanyl)phosphoryl]sulfanylpropane
Etofenprox
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C25 H28 O3
Molecular Weight
376.49
Accurate Mass
376.2038
SMILES
CCOc1ccc(cc1)C(C)(C)COCc2cccc(Oc3ccccc3)c2
InChI
InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3
IUPAC
1-ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene
Etoxazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C21 H23 F2 N O2
Molecular Weight
359.41
Accurate Mass
359.1697
SMILES
CCOc1cc(ccc1C2COC(=N2)c3c(F)cccc3F)C(C)(C)C
InChI
InChI=1S/C21H23F2NO2/c1-5-25-18-11-13(21(2,3)4)9-10-14(18)17-12-26-20(24-17)19-15(22)7-6-8-16(19)23/h6-11,17H,5,12H2,1-4H3
IUPAC
4-(4-tert-butyl-2-ethoxyphenyl)-2-(2,6-difluorophenyl)-4,5-dihydro-1,3-oxazole
Fenhexamid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H17 Cl2 N O2
Molecular Weight
302.20
Accurate Mass
301.0636
SMILES
CC1(CCCCC1)C(=O)Nc2ccc(O)c(Cl)c2Cl
InChI
InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)
IUPAC
N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide
Fenoxycarb
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C17 H19 N O4
Molecular Weight
301.34
Accurate Mass
301.1314
SMILES
CCOC(=O)NCCOc1ccc(Oc2ccccc2)cc1
InChI
InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)
IUPAC
ethyl N-[2-(4-phenoxyphenoxy)ethyl]carbamate
Fenpyroximate (E/Z Mix)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C24 H27 N3 O4
Molecular Weight
421.49
Accurate Mass
421.2002
SMILES
Cc1nn(C)c(Oc2ccccc2)c1C=NOCc3ccc(cc3)C(=O)OC(C)(C)C
InChI
InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3
IUPAC
tert-butyl 4-[[(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate
Fipronil
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H4 Cl2 F6 N4 O S
Molecular Weight
437.15
Accurate Mass
435.9387
SMILES
Nc1c(c(nn1c2c(Cl)cc(cc2Cl)C(F)(F)F)C#N)S(=O)C(F)(F)F
InChI
InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2
IUPAC
5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazole-3-carbonitrile
Flonicamid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H6 F3 N3 O
Molecular Weight
229.16
Accurate Mass
229.0463
SMILES
FC(F)(F)c1ccncc1C(=O)NCC#N
InChI
InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)
IUPAC
N-(cyanomethyl)-4-(trifluoromethyl)pyridine-3-carboxamide
Fludioxonil
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H6 F2 N2 O2
Molecular Weight
248.18
Accurate Mass
248.0397
SMILES
FC1(F)Oc2cccc(c2O1)c3c[nH]cc3C#N
InChI
InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H
IUPAC
4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile
Hexythiazox
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C17 H21 Cl N2 O2 S
Molecular Weight
352.88
Accurate Mass
352.1012
SMILES
C[C@H]1[C@@H](SC(=O)N1C(=O)NC2CCCCC2)c3ccc(Cl)cc3
InChI
InChI=1S/C17H21ClN2O2S/c1-11-15(12-7-9-13(18)10-8-12)23-17(22)20(11)16(21)19-14-5-3-2-4-6-14/h7-11,14-15H,2-6H2,1H3,(H,19,21)/t11-,15+/m0/s1
IUPAC
(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide
Imazalil
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H14 Cl2 N2 O
Molecular Weight
297.18
Accurate Mass
296.0483
SMILES
Clc1ccc(C(Cn2ccnc2)OCC=C)c(Cl)c1
InChI
InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2
IUPAC
1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole
Imidacloprid
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C9 H10 Cl N5 O2
Molecular Weight
255.66
Accurate Mass
255.0523
SMILES
[O-][N+](=O)\N=C\1/NCCN1Cc2ccc(Cl)nc2
InChI
InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)
IUPAC
(NE)-N-[1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-ylidene]nitramide
Kresoxim-methyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H19 N O4
Molecular Weight
313.35
Accurate Mass
313.1314
SMILES
CO\N=C(\C(=O)OC)/c1ccccc1COc2ccccc2C
InChI
InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+
IUPAC
methyl (2E)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate
Malathion
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H19 O6 P S2
Molecular Weight
330.36
Accurate Mass
330.0361
SMILES
CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC
InChI
InChI=1S/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3
IUPAC
diethyl 2-dimethoxyphosphinothioylsulfanylbutanedioate
Metalaxyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H21 N O4
Molecular Weight
279.33
Accurate Mass
279.1471
SMILES
COCC(=O)N(C(C)C(=O)OC)c1c(C)cccc1C
InChI
InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3
IUPAC
methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)propanoate
Methiocarb
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H15 N O2 S
Molecular Weight
225.31
Accurate Mass
225.0823
SMILES
CNC(=O)Oc1cc(C)c(SC)c(C)c1
InChI
InChI=1S/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)
IUPAC
(3,5-dimethyl-4-methylsulfanylphenyl) N-methylcarbamate
Methomyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 H10 N2 O2 S
Molecular Weight
162.21
Accurate Mass
162.0463
SMILES
CNC(=O)ON=C(C)SC
InChI
InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)
IUPAC
methyl N-(methylcarbamoyloxy)ethanimidothioate
MGK 264
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C17 H25 N O2
Molecular Weight
275.39
Accurate Mass
275.1885
SMILES
CCCCC(CC)CN1C(=O)C2[C@@H]3C[C@@H](C=C3)C2C1=O
InChI
InChI=1S/C17H25NO2/c1-3-5-6-11(4-2)10-18-16(19)14-12-7-8-13(9-12)15(14)17(18)20/h7-8,11-15H,3-6,9-10H2,1-2H3/t11?,12-,13+,14?,15?
IUPAC
N-(2-Ethylhexyl)-5-norbornen-2,3-dicarboximide
Myclobutanil
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H17 Cl N4
Molecular Weight
288.78
Accurate Mass
288.1142
SMILES
CCCCC(Cn1cncn1)(C#N)c2ccc(Cl)cc2
InChI
InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3
IUPAC
2-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile
Naled
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C4 H7 Br2 Cl2 O4 P
Molecular Weight
380.78
Accurate Mass
377.7826
SMILES
COP(=O)(OC)OC(Br)C(Cl)(Cl)Br
InChI
InChI=1S/C4H7Br2Cl2O4P/c1-10-13(9,11-2)12-3(5)4(6,7)8/h3H,1-2H3
IUPAC
(1,2-dibromo-2,2-dichloroethyl) dimethyl phosphate
Oxamyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H13 N3 O3 S
Molecular Weight
219.26
Accurate Mass
219.0678
SMILES
CNC(=O)O\N=C(/SC)\C(=O)N(C)C
InChI
InChI=1S/C7H13N3O3S/c1-8-7(12)13-9-5(14-4)6(11)10(2)3/h1-4H3,(H,8,12)/b9-5-
IUPAC
methyl (1Z)-2-(dimethylamino)-N-(methylcarbamoyloxy)-2-oxoethanimidothioate
Paclobutrazol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H20 Cl N3 O
Molecular Weight
293.79
Accurate Mass
293.1295
SMILES
CC(C)(C)[C@@H](O)[C@@H](Cc1ccc(Cl)cc1)n2cncn2
InChI
InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3/t13-,14+/m1/s1
IUPAC
(2R,3R)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol
Parathion-methyl
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C8 H10 N O5 P S
Molecular Weight
263.21
Accurate Mass
263.0017
SMILES
COP(=S)(OC)Oc1ccc(cc1)[N+](=O)[O-]
InChI
InChI=1S/C8H10NO5PS/c1-12-15(16,13-2)14-8-5-3-7(4-6-8)9(10)11/h3-6H,1-2H3
IUPAC
dimethoxy-(4-nitrophenoxy)-sulfanylidene-?^{5}-phosphane
Permethrin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C21 H20 Cl2 O3
Molecular Weight
391.29
Accurate Mass
390.0789
SMILES
CC1(C)C(C=C(Cl)Cl)C1C(=O)OCc2cccc(Oc3ccccc3)c2
InChI
InChI=1S/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3
IUPAC
(3-phenoxyphenyl)methyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Phosmet
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H12 N O4 P S2
Molecular Weight
317.32
Accurate Mass
316.9945
SMILES
COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O
InChI
InChI=1S/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3
IUPAC
2-(dimethoxyphosphinothioylsulfanylmethyl)isoindole-1,3-dione
Piperonyl butoxide
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H30 O5
Molecular Weight
338.44
Accurate Mass
338.2093
SMILES
CCCCOCCOCCOCc1cc2OCOc2cc1CCC
InChI
InChI=1S/C19H30O5/c1-3-5-7-20-8-9-21-10-11-22-14-17-13-19-18(23-15-24-19)12-16(17)6-4-2/h12-13H,3-11,14-15H2,1-2H3
IUPAC
5-[2-(2-butoxyethoxy)ethoxymethyl]-6-propyl-1,3-benzodioxole
Prallethrin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H24 O3
Molecular Weight
300.39
Accurate Mass
300.1725
SMILES
CC(=CC1C(C(=O)OC2CC(=O)C(=C2C)CC#C)C1(C)C)C
InChI
InChI=1S/C19H24O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h1,9,14,16-17H,8,10H2,2-6H3
IUPAC
(2-methyl-4-oxo-3-prop-2-ynylcyclopent-2-en-1-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Propiconazole
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C15 H17 Cl2 N3 O2
Molecular Weight
342.22
Accurate Mass
341.0698
SMILES
CCCC1COC(Cn2cncn2)(O1)c3ccc(Cl)cc3Cl
InChI
InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3
IUPAC
1-[[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole
Propoxur
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H15 N O3
Molecular Weight
209.24
Accurate Mass
209.1052
SMILES
CNC(=O)Oc1ccccc1OC(C)C
InChI
InChI=1S/C11H15NO3/c1-8(2)14-9-6-4-5-7-10(9)15-11(13)12-3/h4-8H,1-3H3,(H,12,13)
IUPAC
(2-propan-2-yloxyphenyl) N-methylcarbamate
Pyridaben
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C19 H25 Cl N2 O S
Molecular Weight
364.93
Accurate Mass
364.1376
SMILES
CC(C)(C)N1N=CC(=C(Cl)C1=O)SCc2ccc(cc2)C(C)(C)C
InChI
InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3
IUPAC
2-tert-butyl-5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloropyridazin-3-one
Spinetoram
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C42 H69 N O10 or C43 H69 N O10
Molecular Weight
748 or 760
Accurate Mass
-
SMILES
CCO[C@@H]1[C@@H](OC)[C@H](C)O[C@@H](O[C@@H]2C[C@H]3CC[C@H]4[C@@H]5CC(=O)O[C@@H](CC)CCC[C@H](O[C@H]6CC[C@@H]([C@@H](C)O6)N(C)C)[C@@H](C)C(=O)C5=C[C@H]4[C@@H]3C2)[C@@H]1OC.CCO[C@@H]7[C@@H](OC)[C@H](C)O[C@@H](O[C@H]8C[C@@H]9[C@@H](C8)C(=C[C@H]%10[C@@H]%11CC(=O)O[C@@H](CC)CCC[C@H](O[C@H]%12CC[C@@H]([C@@H](C)O%12)N(C)C)[C@@H](C)C(=O)C%11=C[C@@H]9%10)C)[C@@H]7OC
Spinosad
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C42 H67 N O10 . C41 H65 N O10
Molecular Weight
-
Accurate Mass
-
Spiromesifen
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C23 H30 O4
Molecular Weight
370.48
Accurate Mass
370.2144
SMILES
Cc1cc(C)c(C2=C(OC(=O)CC(C)(C)C)C3(CCCC3)OC2=O)c(C)c1
InChI
InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3
IUPAC
[2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl] 3,3-dimethylbutanoate
Spirotetramat
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C21 H27 N O5
Molecular Weight
373.44
Accurate Mass
373.1889
SMILES
CCOC(=O)OC1=C(C(=O)N[C@@]12CC[C@@H](CC2)OC)c3cc(C)ccc3C
InChI
InChI=1S/C21H27NO5/c1-5-26-20(24)27-18-17(16-12-13(2)6-7-14(16)3)19(23)22-21(18)10-8-15(25-4)9-11-21/h6-7,12,15H,5,8-11H2,1-4H3,(H,22,23)/t15-,21+
IUPAC
[3-(2,5-dimethylphenyl)-8-methoxy-2-oxo-1-azaspiro[4.5]dec-3-en-4-yl] ethyl carbonate
Spiroxamine
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C18 H35 N O2
Molecular Weight
297.48
Accurate Mass
297.2668
SMILES
CCCN(CC)CC1COC2(CCC(CC2)C(C)(C)C)O1
InChI
InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3
IUPAC
N-[(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)methyl]-N-ethylpropan-1-amine
Tebuconazole
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C16H22ClN3O
Molecular Weight
307.82
Accurate Mass
307.1451
SMILES
CC(C)(C)C(O)(CCc1ccc(Cl)cc1)Cn2cncn2
InChI
InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3
IUPAC
1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentan-3-ol
Thiacloprid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H9 Cl N4 S
Molecular Weight
252.72
Accurate Mass
252.0236
SMILES
Clc1ccc(CN2CCS/C/2=N\C#N)cn1
InChI
InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2/b14-10-
IUPAC
(Z)-[3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene]cyanamide
Thiamethoxam
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C8 H10 Cl N5 O3 S
Molecular Weight
291.71
Accurate Mass
291.0193
SMILES
CN1COCN(Cc2cnc(Cl)s2)C1=N[N+](=O)[O-]
InChI
InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3
IUPAC
N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-ylidene]nitramide
Trifloxystrobin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C20 H19 F3 N2 O4
Molecular Weight
408.37
Accurate Mass
408.1297
SMILES
CO\N=C(\C(=O)OC)/c1ccccc1CO\N=C(/C)\c2cccc(c2)C(F)(F)F
InChI
InChI=1S/C20H19F3N2O4/c1-13(14-8-6-9-16(11-14)20(21,22)23)24-29-12-15-7-4-5-10-17(15)18(25-28-3)19(26)27-2/h4-11H,12H2,1-3H3/b24-13+,25-18+
IUPAC
methyl (2E)-2-methoxyimino-2-[2-[[(E)-1-[3-(trifluoromethyl)phenyl]ethylideneamino]oxymethyl]phenyl]acetate
Product Data
Storage Temperature
-18°C
Shipping Temperature
Room Temperature
Country of Origin
UNITED STATES
Product Type
Native/Parent
Product Format
Mixture
Solvent
Acetonitrile
