CAS
8063-17-0 Purity
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8063-17-0 Purity
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1-Cyclohexene-1-aceticacid,a-cyano-,methyl ester
CAS
80632-53-7
Catalog Number
ACM80632537
Category
Other Products
Molecular Weight
179.2157
Molecular Formula
C10H13NO2
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Specification
Synonyms
MolPort-001-790-611, EINECS 279-519-1, CID4051647, Methyl 2-cyano-2-(1-cyclohexenyl)acetate, Methyl alpha-cyano-1-cyclohexene-1-acetate, 80632-53-7
IUPAC Name
methyl 2-cyano-2-(cyclohexen-1-yl)acetate
Canonical SMILES
COC(=O)C(C#N)C1=CCCCC1
InChI Key
PZHBBPQFEOOLQL-UHFFFAOYSA-N
Boiling Point
280.4ºC at 760mmHg
Flash Point
127.5ºC
Density
1.098g/cm³
EC Number
279-519-1
Exact Mass
179.09500
H-Bond Acceptor
3
H-Bond Donor
0
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