HJ 822-2017 Aromatic Amines Mixture 133 1000 µg/mL in Toluene
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- structure.search.product.name HJ 822-2017 Aromatic Amines Mixture 133 1000 µg/mL in Toluene
- Product Code: DRE-A50000133TO
- Brand: Dr. Ehrenstorfer
Product Overview
Product Code
DRE-A50000133TO
CAS Number
19 AnalytesProduct Format
Mixture
Solvent
Toluene
Product Categories
Reference Materials for Environmental Testing Regulations , Dr. Ehrenstorfer
Documentation
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Product Information
Analyte Data
Analyte Name
Measured Value
CAS Number
Molecular Structure
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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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SMILES
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InChI
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IUPAC
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2,4,5-Trichloroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl3 N
Molecular Weight
196.46
Accurate Mass
194.9409
SMILES
Nc1cc(Cl)c(Cl)cc1Cl
InChI
InChI=1S/C6H4Cl3N/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,10H2
IUPAC
2,4,5-trichloroaniline
2,4,6-Trichloroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl3 N
Molecular Weight
196.46
Accurate Mass
194.9409
SMILES
Nc1c(Cl)cc(Cl)cc1Cl
InChI
InChI=1S/C6H4Cl3N/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2
IUPAC
2,4,6-trichloroaniline
2,4-Dinitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 N3 O4
Molecular Weight
183.12
Accurate Mass
183.028
SMILES
Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C6H5N3O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H,7H2
IUPAC
2,4-dinitroaniline
2,6-Dibromo-4-nitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Br2 N2 O2
Molecular Weight
295.92
Accurate Mass
293.864
SMILES
Nc1c(Br)cc(cc1Br)[N+](=O)[O-]
InChI
InChI=1S/C6H4Br2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2
IUPAC
2,6-dibromo-4-nitroaniline
2-Bromo-4,6-dinitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Br N3 O4
Molecular Weight
262.02
Accurate Mass
260.9385
SMILES
Nc1c(Br)cc(cc1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C6H4BrN3O4/c7-4-1-3(9(11)12)2-5(6(4)8)10(13)14/h1-2H,8H2
IUPAC
2-bromo-4,6-dinitroaniline
2-Bromo-6-chloro-4-nitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Br Cl N2 O2
Molecular Weight
251.46
Accurate Mass
249.9145
SMILES
Nc1c(Cl)cc(cc1Br)[N+](=O)[O-]
InChI
InChI=1S/C6H4BrClN2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2
IUPAC
2-bromo-6-chloro-4-nitroaniline
2-Chloro-4-nitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 Cl N2 O2
Molecular Weight
172.57
Accurate Mass
172.004
SMILES
Nc1ccc(cc1Cl)[N+](=O)[O-]
InChI
InChI=1S/C6H5ClN2O2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H,8H2
IUPAC
2-chloro-4-nitroaniline
2-Chloroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H6 Cl N
Molecular Weight
127.57
Accurate Mass
127.0189
SMILES
Nc1ccccc1Cl
InChI
InChI=1S/C6H6ClN/c7-5-3-1-2-4-6(5)8/h1-4H,8H2
IUPAC
2-chloroaniline
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
3,4-Dichloroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 Cl2 N
Molecular Weight
162.02
Accurate Mass
160.9799
SMILES
Nc1ccc(Cl)c(Cl)c1
InChI
InChI=1S/C6H5Cl2N/c7-5-2-1-4(9)3-6(5)8/h1-3H,9H2
IUPAC
3,4-dichloroaniline
3-Chloroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H6 Cl N
Molecular Weight
127.57
Accurate Mass
127.0189
SMILES
Nc1cccc(Cl)c1
InChI
InChI=1S/C6H6ClN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2
IUPAC
3-chloroaniline
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-Bromoaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H6 Br N
Molecular Weight
172.02
Accurate Mass
170.9684
SMILES
Nc1ccc(Br)cc1
InChI
InChI=1S/C6H6BrN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2
IUPAC
4-bromoaniline
4-Chloro-2-nitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H5 Cl N2 O2
Molecular Weight
172.57
Accurate Mass
172.004
SMILES
Nc1ccc(Cl)cc1[N+](=O)[O-]
InChI
InChI=1S/C6H5ClN2O2/c7-4-1-2-5(8)6(3-4)9(10)11/h1-3H,8H2
IUPAC
4-chloro-2-nitroaniline
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-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
6-Chloro-2,4-dinitroaniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl N3 O4
Molecular Weight
217.57
Accurate Mass
216.989
SMILES
Nc1c(Cl)cc(cc1[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C6H4ClN3O4/c7-4-1-3(9(11)12)2-5(6(4)8)10(13)14/h1-2H,8H2
IUPAC
2-chloro-4,6-dinitroaniline
Aniline
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H7 N
Molecular Weight
93.13
Accurate Mass
93.0578
SMILES
Nc1ccccc1
InChI
InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2
IUPAC
aniline
Dicloran
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C6 H4 Cl2 N2 O2
Molecular Weight
207.01
Accurate Mass
205.965
SMILES
Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-]
InChI
InChI=1S/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2
IUPAC
2,6-dichloro-4-nitroaniline
Product Data
Storage Temperature
-18°C
Shipping Temperature
Room Temperature
Country of Origin
UNITED STATES
Product Format
Mixture
Solvent
Toluene
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