HJ 350-2007 SVOC Mixture 620 1000 µg/mL in Methanol
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- structure.search.product.name HJ 350-2007 SVOC Mixture 620 1000 µg/mL in Methanol
- Product Code: DRE-A50000620ME
- Brand: Dr. Ehrenstorfer
Product Overview
Product Code
DRE-A50000620ME
CAS Number
42 AnalytesProduct Format
Mixture
Solvent
Methanol
Regulatory Method
HJ 350-2007
Product Categories
Dr. Ehrenstorfer, Volatile organic compounds (VOCs), Volatile Organic Compound Research and Reference Materials , GB and HJ Methods
Product Type
Native/ParentDocumentation
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Product Information
Analyte Data
Analyte Name
Measured Value
CAS Number
Molecular Structure
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Bis-(2-chloro-1-methylethyl)ether
1000.0 μg/mL
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CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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Molecular Weight
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Accurate Mass
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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1,2,4-Trichlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl3
Molecular Weight
181.45
Accurate Mass
179.93
SMILES
Clc1ccc(Cl)c(Cl)c1
InChI
InChI=1S/C6H3Cl3/c7-4-1-2-5(8)6(9)3-4/h1-3H
IUPAC
1,2,4-trichlorobenzene
1,2-Dichlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl2
Molecular Weight
147.00
Accurate Mass
145.969
SMILES
Clc1ccccc1Cl
InChI
InChI=1S/C6H4Cl2/c7-5-3-1-2-4-6(5)8/h1-4H
IUPAC
1,2-dichlorobenzene
1,3-Dichlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl2
Molecular Weight
147.00
Accurate Mass
145.969
SMILES
Clc1cccc(Cl)c1
InChI
InChI=1S/C6H4Cl2/c7-5-2-1-3-6(8)4-5/h1-4H
IUPAC
1,3-dichlorobenzene
1,4-Dichlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl2
Molecular Weight
147.00
Accurate Mass
145.969
SMILES
Clc1ccc(Cl)cc1
InChI
InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H
IUPAC
1,4-dichlorobenzene
2,4,5-Trichlorophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl3 O
Molecular Weight
197.45
Accurate Mass
195.9249
SMILES
Oc1cc(Cl)c(Cl)cc1Cl
InChI
InChI=1S/C6H3Cl3O/c7-3-1-5(9)6(10)2-4(3)8/h1-2,10H
IUPAC
2,4,5-trichlorophenol
2,4,6-Trichlorophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H3 Cl3 O
Molecular Weight
197.45
Accurate Mass
195.9249
SMILES
Oc1c(Cl)cc(Cl)cc1Cl
InChI
InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
IUPAC
2,4,6-trichlorophenol
2,4-Dichlorophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl2 O
Molecular Weight
163.00
Accurate Mass
161.9639
SMILES
Oc1ccc(Cl)cc1Cl
InChI
InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
IUPAC
2,4-dichlorophenol
2,4-Dimethylphenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C8 H10 O
Molecular Weight
122.16
Accurate Mass
122.0732
SMILES
Cc1ccc(O)c(C)c1
InChI
InChI=1S/C8H10O/c1-6-3-4-8(9)7(2)5-6/h3-5,9H,1-2H3
IUPAC
2,4-dimethylphenol
2,4-Dinitrophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 N2 O5
Molecular Weight
184.11
Accurate Mass
184.012
SMILES
Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H
IUPAC
2,4-dinitrophenol
2,4-Dinitrotoluene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H6 N2 O4
Molecular Weight
182.13
Accurate Mass
182.0328
SMILES
Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3
IUPAC
1-methyl-2,4-dinitrobenzene
2,6-Dinitrotoluene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H6 N2 O4
Molecular Weight
182.13
Accurate Mass
182.0328
SMILES
Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C7H6N2O4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3
IUPAC
2-methyl-1,3-dinitrobenzene
2-Chloronaphthalene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H7 Cl
Molecular Weight
162.62
Accurate Mass
162.0236
SMILES
Clc1ccc2ccccc2c1
InChI
InChI=1S/C10H7Cl/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
IUPAC
2-chloronaphthalene
2-Chlorophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 Cl O
Molecular Weight
128.56
Accurate Mass
128.0029
SMILES
Oc1ccccc1Cl
InChI
InChI=1S/C6H5ClO/c7-5-3-1-2-4-6(5)8/h1-4,8H
IUPAC
2-chlorophenol
2-Methyl-4,6-dinitrophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H6 N2 O5
Molecular Weight
198.13
Accurate Mass
198.0277
SMILES
Cc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3
IUPAC
2-methyl-4,6-dinitrophenol
2-Methylnaphthalene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H10
Molecular Weight
142.20
Accurate Mass
142.0783
SMILES
Cc1ccc2ccccc2c1
InChI
InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3
IUPAC
2-methylnaphthalene
2-Methylphenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H8 O
Molecular Weight
108.14
Accurate Mass
108.0575
SMILES
Cc1ccccc1O
InChI
InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3
IUPAC
2-methylphenol
2-Nitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H6 N2 O2
Molecular Weight
138.12
Accurate Mass
138.0429
SMILES
Nc1ccccc1[N+](=O)[O-]
InChI
InChI=1S/C6H6N2O2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H,7H2
IUPAC
2-nitroaniline
2-Nitrophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 N O3
Molecular Weight
139.11
Accurate Mass
139.0269
SMILES
Oc1ccccc1[N+](=O)[O-]
InChI
InChI=1S/C6H5NO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H
IUPAC
2-nitrophenol
3-Nitroaniline
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C6 H6 N2 O2
Molecular Weight
138.12
Accurate Mass
138.0429
SMILES
Nc1cccc(c1)[N+](=O)[O-]
InChI
InChI=1S/C6H6N2O2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H,7H2
IUPAC
3-nitroaniline
4-Chloro-3-methylphenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H7 Cl O
Molecular Weight
142.58
Accurate Mass
142.0185
SMILES
Cc1cc(O)ccc1Cl
InChI
InChI=1S/C7H7ClO/c1-5-4-6(9)2-3-7(5)8/h2-4,9H,1H3
IUPAC
4-chloro-3-methylphenol
4-Chloroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H6 Cl N
Molecular Weight
127.57
Accurate Mass
127.0189
SMILES
Nc1ccc(Cl)cc1
InChI
InChI=1S/C6H6ClN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2
IUPAC
4-chloroaniline
4-Chlorophenyl phenyl ether
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H9 Cl O
Molecular Weight
204.65
Accurate Mass
204.0342
SMILES
Clc1ccc(Oc2ccccc2)cc1
InChI
InChI=1S/C12H9ClO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
IUPAC
1-chloro-4-phenoxybenzene
4-Methylphenol (p-Cresol)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H8 O
Molecular Weight
108.14
Accurate Mass
108.0575
SMILES
Cc1ccc(O)cc1
InChI
InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3
IUPAC
4-methylphenol
4-Nitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H6 N2 O2
Molecular Weight
138.12
Accurate Mass
138.0429
SMILES
Nc1ccc(cc1)[N+](=O)[O-]
InChI
InChI=1S/C6H6N2O2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H,7H2
IUPAC
4-nitroaniline
4-Nitrophenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 N O3
Molecular Weight
139.11
Accurate Mass
139.0269
SMILES
Oc1ccc(cc1)[N+](=O)[O-]
InChI
InChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H
IUPAC
4-nitrophenol
Benzoic acid
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H6 O2
Molecular Weight
122.12
Accurate Mass
122.0368
SMILES
OC(=O)c1ccccc1
InChI
InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
IUPAC
benzoic acid
Benzyl alcohol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C7 H8 O
Molecular Weight
108.14
Accurate Mass
108.0575
SMILES
OCc1ccccc1
InChI
InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
IUPAC
phenylmethanol
Bis(2-chloroethoxy)methane
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 H10 Cl2 O2
Molecular Weight
173.04
Accurate Mass
172.0058
SMILES
ClCCOCOCCCl
InChI
InChI=1S/C5H10Cl2O2/c6-1-3-8-5-9-4-2-7/h1-5H2
IUPAC
1-chloro-2-(2-chloroethoxymethoxy)ethane
Bis-(2-chloro-1-methylethyl)ether
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H12 Cl2 O
Molecular Weight
171.06
Accurate Mass
170.0265
SMILES
CC(CCl)OC(C)CCl
InChI
InChI=1S/C6H12Cl2O/c1-5(3-7)9-6(2)4-8/h5-6H,3-4H2,1-2H3
IUPAC
1-chloro-2-(1-chloropropan-2-yloxy)propane
Bis-(2-chloroethyl)ether
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C4 H8 Cl2 O
Molecular Weight
143.01
Accurate Mass
141.9952
SMILES
ClCCOCCCl
InChI
InChI=1S/C4H8Cl2O/c5-1-3-7-4-2-6/h1-4H2
IUPAC
1-chloro-2-(2-chloroethoxy)ethane
Dibenzofuran
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H8 O
Molecular Weight
168.19
Accurate Mass
168.0575
SMILES
o1c2ccccc2c3ccccc13
InChI
InChI=1S/C12H8O/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H
IUPAC
dibenzofuran
Hexachlorobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 Cl6
Molecular Weight
284.78
Accurate Mass
281.8131
SMILES
Clc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
InChI
InChI=1S/C6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9
IUPAC
1,2,3,4,5,6-hexachlorobenzene
Hexachlorobutadiene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C4 Cl6
Molecular Weight
260.76
Accurate Mass
257.8131
SMILES
ClC(=C(Cl)C(=C(Cl)Cl)Cl)Cl
InChI
InChI=1S/C4Cl6/c5-1(3(7)8)2(6)4(9)10
IUPAC
1,1,2,3,4,4-hexachlorobuta-1,3-diene
Hexachlorocyclopentadiene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 Cl6
Molecular Weight
272.77
Accurate Mass
269.8131
SMILES
ClC1=C(Cl)C(Cl)(Cl)C(=C1Cl)Cl
InChI
InChI=1S/C5Cl6/c6-1-2(7)4(9)5(10,11)3(1)8
IUPAC
1,2,3,4,5,5-hexachlorocyclopenta-1,3-diene
Hexachloroethane
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C2 Cl6
Molecular Weight
236.74
Accurate Mass
233.8131
SMILES
ClC(Cl)(Cl)C(Cl)(Cl)Cl
InChI
InChI=1S/C2Cl6/c3-1(4,5)2(6,7)8
IUPAC
1,1,1,2,2,2-hexachloroethane
Isophorone
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C9 H14 O
Molecular Weight
138.21
Accurate Mass
138.1045
SMILES
CC1=CC(=O)CC(C)(C)C1
InChI
InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
IUPAC
3,5,5-trimethylcyclohex-2-en-1-one
N-Nitroso-di-n-propylamine
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H14 N2 O
Molecular Weight
130.19
Accurate Mass
130.1106
SMILES
CCCN(CCC)N=O
InChI
InChI=1S/C6H14N2O/c1-3-5-8(7-9)6-4-2/h3-6H2,1-2H3
IUPAC
N,N-dipropylnitrous amide
N-Nitroso-diphenylamine
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H10 N2 O
Molecular Weight
198.22
Accurate Mass
198.0793
SMILES
O=NN(c1ccccc1)c2ccccc2
InChI
InChI=1S/C12H10N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
IUPAC
N,N-diphenylnitrous amide
Nitrobenzene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 N O2
Molecular Weight
123.11
Accurate Mass
123.032
SMILES
[O-][N+](=O)c1ccccc1
InChI
InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H
IUPAC
nitrobenzene
PBDE 3 (4-Bromodiphenyl Ether)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C12 H9 Br O
Molecular Weight
249.10
Accurate Mass
247.9837
SMILES
Brc1ccc(Oc2ccccc2)cc1
InChI
InChI=1S/C12H9BrO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
IUPAC
1-bromo-4-phenoxybenzene
Pentachlorophenol
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C6 H Cl5 O
Molecular Weight
266.34
Accurate Mass
263.847
SMILES
Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
InChI
InChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H
IUPAC
2,3,4,5,6-pentachlorophenol
Phenol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H6 O
Molecular Weight
94.11
Accurate Mass
94.0419
SMILES
Oc1ccccc1
InChI
InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
IUPAC
phenol
Product Data
Storage Temperature
-18°C
Shipping Temperature
-18°C
Country of Origin
UNITED STATES
Product Format
Mixture
Solvent
Methanol