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Diss Factsheets

Identification

Chemical structure
Display Name:
α-n-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile
EC Number:
410-400-0
EC Name:
α-n-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile
CAS Number:
88671-89-0
Molecular formula:
C15H17ClN4
IUPAC Name:
2-(4-chlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]hexanenitrile

Type of Substance

Composition:
mono-constituent substance
Origin:
organic

Substance Identifiers

Compositions

Boundary Composition(s) open all close all

State Form:
other: Solid


Constituent 1
Chemical structure
Reference substance name:
α-n-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile
EC Number:
410-400-0
EC Name:
α-n-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile
CAS Number:
88671-89-0
Molecular formula:
C15H17ClN4
IUPAC Name:
2-(4-chlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]hexanenitrile

Legal Entity Composition(s) open all close all

State Form:
solid: particulate/powder
Degree of purity:
>= 95 - <= 96.5 % (w/w)


Constituent 1
Chemical structure
Reference substance name:
α-n-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile
EC Number:
410-400-0
EC Name:
α-n-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile
CAS Number:
88671-89-0
Molecular formula:
C15H17ClN4
IUPAC Name:
2-(4-chlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]hexanenitrile
Impurity 1
Chemical structure
Reference substance name:
1-methyl-2-pyrrolidone
EC Number:
212-828-1
EC Name:
1-methyl-2-pyrrolidone
CAS Number:
872-50-4
Molecular formula:
C5H9NO
IUPAC Name:
1-methylpyrrolidin-2-one
Impurity 2
Chemical structure
Reference substance name:
2-(4-chlorophenyl)hexanenitrile
CAS Number:
2124-74-5
Molecular formula:
C12H14ClN
IUPAC Name:
2-(4-chlorophenyl)hexanenitrile
Impurity 3
Chemical structure
Reference substance name:
2-(4-chlorophenyl)-2-(4H-1,2,4-triazol-4-ylmethyl)hexanenitrile
CAS Number:
163498-01-9
Molecular formula:
C15H17ClN4
IUPAC Name:
2-(4-chlorophenyl)-2-(4H-1,2,4-triazol-4-ylmethyl)hexanenitrile

Composition(s) generated upon use

Other types of composition(s)