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346632 Sigma-Aldrich

2-Chlorohydrocinnamonitrile

99%

Synonym: 3-(2-Chlorophenyl)propionitrile

  • CAS Number 7315-17-5

  • Linear Formula ClC6H4CH2CH2CN

  • Molecular Weight 165.62

  •  MDL number MFCD00019873

  •  PubChem Substance ID 24861422

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C8 to C9, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds - Organic Building Blocks,
assay   99%
refractive index   n20/D 1.539 (lit.)
bp   83 °C/0.15 mmHg (lit.)
density   1.139 g/mL at 25 °C (lit.)
SMILES string   Clc1ccccc1CCC#N
InChI   1S/C9H8ClN/c10-9-6-2-1-4-8(9)5-3-7-11/h1-2,4,6H,3,5H2
InChI key   MMTXIUJWFHJGBA-UHFFFAOYSA-N

Description

General description

2-Chlorohydrocinnamonitrile is the thermal degradation product of 2-chlorobenzylidenemalononitrile (CS riot control agent).

Application

2-Chlorohydrocinnamonitrile was used as analytical standard for the GC-MS detection of 2-chlorobenzylidenemalononitrile (CS riot control agent).

Packaging

1 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Target organs 
Respiratory system
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
235.4 °F - closed cup
Flash Point(C) 
113 °C - closed cup

Documents

Certificate of Analysis (COA)

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Certificate of Origin (COO)

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Meet Synthia - Retrosynthesis Sofware
Protocols & Articles
Peer-Reviewed Papers
15

References

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