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3,5-Dimethylbenzonitrile

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3,5-Dimethylbenzonitrile / CAS : 22445-42-7

Appearance - UN 3276
HS 29269090 DG Class 0
Synonyms Benzonitrile,3,5-Dimethyl; 3,5-Dimethyl Benzonitrile; 3,5-Dimethyl-Benzonitril; 3,3-Dimethylbenzonitrile; 3,5-Dimethyl-Benzonitrile
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Properties

Summary

Formula
C9H9N
Molecular Mass
131.17400
Exact Mass
131.07300
PSA
23.79000
Logp
2.17508
IUPAC
3,5-dimethylbenzonitrile
SMILES
CC1=CC(=CC(=C1)C#N)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
42-43°C
Density
0.99 g/cm3
Boiling Point
243.1ºC at 760 mmHg
Flash Point
100.8ºC

Export information

HS Code
29269090
Export Rebate
13%
UN No.
3276
DG-Class
0
Risk Code
R20/21/22
Safety Label
Xi

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