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3-Cyanoindole

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3-Cyanoindole / CAS : 5457-28-3

Appearance Light yellow crystalline powder UN 3439
HS 2933990099 DG Class -
Synonyms 1H-Indole-3-Carbonitrile; Indole-3-Carbonitrile; 3-Indolecarbonitrile; 3-Cyano-1H-Indole; 1H-Indole-3-Kohlenitrile; (1H)-Indole-3-Carbonitrile; 1H-Indol-3-yl Cyanide
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Properties

Summary

Formula
C9H6N2
Molecular Mass
142.15700
Exact Mass
142.05300
PSA
39.58000
Logp
2.03958
IUPAC
1H-indole-3-carbonitrile
SMILES
C1=CC=C2C(=C1)C(=CN2)C#N

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
179-182 °C(lit.)
Density
1.2±0.1 g/cm3
Boiling Point
350.0±15.0 °C at 760 mmHg
Flash Point
121.9±5.6 °C
Appearance
Light yellow crystalline powder

Export information

HS Code
2933990099
Export Rebate
13%
UN No.
3439
Risk Code
R20/21/22-36/37/38
Safety Label
Xn

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