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Cembrene
[CAS# 1898-13-1]

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Identification
Classification Chemical reagent >> Organic reagent >> Olefins (cyclic and non-cyclic)
Name Cembrene
Synonyms (1E,3Z,6E,10Z)-3,7,11-Trimethyl-14-Propan-2-Ylcyclotetradeca-1,3,6,10-Tetraene; (1E,3Z,6E,10E)-14-Isopropyl-3,7,11-Trimethyl-Cyclotetradeca-1,3,6,10-Tetraene; (1E,3Z,6E,10Z)-14-Isopropyl-3,7,11-Trimethyl-Cyclotetradeca-1,3,6,10-Tetraene
Molecular Structure CAS#: 1898-13-1, Cembrene
Molecular Formula C20H32
Molecular Weight 272.47
CAS Registry Number 1898-13-1
SMILES CC(C1\C=C\C(=C/C\C=C(CC/C=C(CC1)/C)/C)C)C
InChI 1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,10-12,14,16,20H,6-7,9,13,15H2,1-5H3/b14-12+,17-8+,18-10-,19-11-
InChIKey DMHADBQKVWXPPM-GMVDCNKVSA-N
Properties
Density 0.832g/cm3 (Cal.)
Boiling point 365.222°C at 760 mmHg (Cal.)
Flash point 166.839°C (Cal.)
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