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Home >> Chemical Listing >> Page 2772 >> [(1S,6S)-6-Acetyl-2-cyclohexen-1-yl]acetonitrile

[(1S,6S)-6-Acetyl-2-cyclohexen-1-yl]acetonitrile
[CAS# 85251-21-4]

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Identification
Name [(1S,6S)-6-Acetyl-2-cyclohexen-1-yl]acetonitrile
Synonyms 2-((1S,6S)-6-acetylcyclohex-2-en-1-yl)acetonitrile
Molecular Structure CAS#: 85251-21-4, [(1S,6S)-6-Acetyl-2-cyclohexen-1-yl]acetonitrile
Molecular Formula C10H13NO
Molecular Weight 163.22
CAS Registry Number 85251-21-4
SMILES CC(=O)[C@H]1CCC=C[C@@H]1CC#N
InChI 1S/C10H13NO/c1-8(12)10-5-3-2-4-9(10)6-7-11/h2,4,9-10H,3,5-6H2,1H3/t9-,10-/m1/s1
InChIKey RRPCUFXFMHDVRP-NXEZZACHSA-N
Properties
Density 1.008g/cm3 (Cal.)
Boiling point 301.949°C at 760 mmHg (Cal.)
Flash point 136.414°C (Cal.)
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