144614
4-Chlorocinnamonitrile, mixture of cis and trans
98%
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About This Item
Linear Formula:
ClC6H4CH=CHCN
CAS Number:
Molecular Weight:
163.60
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
249-025-0
MDL number:
Assay:
98%
Form:
solid
InChI key
PPCNBCKABHGVMX-OWOJBTEDSA-N
InChI
1S/C9H6ClN/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6H/b2-1+
SMILES string
Clc1ccc(\C=C\C#N)cc1
assay
98%
form
solid
mp
55-70 °C (lit.)
functional group
chloro, nitrile
Application
4-Chlorocinnamonitrile was used in the synthesis of ethyl-1-(4-chlorophenyl)-2-cyanoethyl(diethoxymethyl)phosphinate. It was used to compare the radical and homocopolymerization ability of geometrical isomers of cinnamonitriles.
signalword
Warning
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Diethoxymethylphosphonites and phosphinates. Intermediates for thesynthesis of a, ?-and X aminoalkylphosphonous acids.
Dingwalla JG, et al.
Tetrahedron, 45(12), 3787-3808 (1989)
Radical homo-and copolymerization of ring-substituted trans-and cis-cinnamonitriles.
Tanaka H, et al.
Makromol. Chem., Rapid Commun., 14(10), 649-655 (1993)
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