118133
2-Cyanophenylacetonitrile
97%
Synonym(s):
α-Cyano-o-tolunitrile, Homophthalonitrile
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About This Item
Linear Formula:
NCC6H4CH2CN
CAS Number:
Molecular Weight:
142.16
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
assay
97%
functional group
nitrile
SMILES string
N#CCc1ccccc1C#N
InChI
1S/C9H6N2/c10-6-5-8-3-1-2-4-9(8)7-11/h1-4H,5H2
InChI key
GKHSEDFDYXZGCG-UHFFFAOYSA-N
General description
2-Cyanophenylacetonitrile undergoes carbocyclization reaction with bromoacrylonitriles to give naphthylamine.
Application
2-Cyanophenylacetonitrile may be used in the synthesis of 2, 5-diphenylpyrazine.
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral
Storage Class
11 - Combustible Solids
wgk_germany
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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Single step synthesis of 2, 4-dicyanonaphthylamines from synthetic equivalents of a-cyanoalkynes.
Reux D and Pochat F.
Journal of the Chemical Society. Chemical Communications, 20, 1419-1420 (1991)
A novel synthesis of 2, 5-diphenylpyrazine.
Luo M, et al.
Research on Chemical Intermediates, 36(5), 491-494 (2010)
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