29252
Cyclohexene-1-carbonitrile
≥97.0%
Synonym(s):
1-Cyanocyclohexene
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About This Item
Empirical Formula (Hill Notation):
C7H9N
CAS Number:
Molecular Weight:
107.15
Beilstein:
385837
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
≥97.0%
refractive index
n20/D 1.482 (lit.)
density
0.946 g/mL at 20 °C (lit.)
SMILES string
N#CC1=CCCCC1
InChI
1S/C7H9N/c8-6-7-4-2-1-3-5-7/h4H,1-3,5H2
InChI key
GTMWGXABXQTZRJ-UHFFFAOYSA-N
General description
Irradiation of cyclohexene-1-carbonitrile with the full arc of Hanovia 450-W lamp yields bicycle[3.1.0]hexane-1-carbonitrile. Photochemistry of cyclohexene-1-carbonitrile has been investigated.
Application
Cyclohexene-1-carbonitrile has been used in the preparation of cyclohexene-1-carboxylic acid.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
181.4 °F - closed cup
Flash Point(C)
83 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Customers Also Viewed
Preparation and photochemistry of cyclohexene-1-carbonitriles.
McCullough JJ and Manning C.
The Journal of Organic Chemistry, 43(14), 2839-2842 (1978)
Aromatization of cyclohexanecarboxylic acid.
B M Babior et al.
The Journal of biological chemistry, 241(16), 3643-3651 (1966-08-25)
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