ChemSpider 2D Image | gamma-curcumene | C15H24

γ-curcumene

  • Molecular FormulaC15H24
  • Average mass204.351 Da
  • Monoisotopic mass204.187805 Da
  • ChemSpider ID26606386
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,3-Cyclohexadiene, 1-[(1R)-1,5-dimethyl-4-hexen-1-yl]-4-methyl- [ACD/Index Name]
1-Methyl-4-[(2R)-6-methyl-5-hepten-2-yl]-1,3-cyclohexadien [German] [ACD/IUPAC Name]
1-Methyl-4-[(2R)-6-methyl-5-hepten-2-yl]-1,3-cyclohexadiene [ACD/IUPAC Name]
1-Méthyl-4-[(2R)-6-méthyl-5-heptén-2-yl]-1,3-cyclohexadiène [French] [ACD/IUPAC Name]
γ-curcumene
&γ;-curcumene
1,3-CYCLOHEXADIENE, 1-(1,5-DIMETHYL-4-HEXENYL)-4-METHYL-, (R)-
1-methyl-4-[(2R)-6-methylhept-5-en-2-yl]cyclohexa-1,3-diene
28976-68-3 [RN]

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CHEBI:63696 [DBID]
  • Miscellaneous
    • Chemical Class:

      A sesquiterpene that is cyclohexa-1,3-diene which is substituted by a methyl group at position 1 and a 6-methylhept-5-en-2-yl group at position 4 (the <stereo>R</stereo> enantiomer). ChEBI CHEBI:63696

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 277.0±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 49.5±0.8 kJ/mol
Flash Point: 110.6±13.8 °C
Index of Refraction: 1.490
Molar Refractivity: 68.5±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.72
ACD/LogD (pH 5.5): 5.89
ACD/BCF (pH 5.5): 17688.02
ACD/KOC (pH 5.5): 38201.07
ACD/LogD (pH 7.4): 5.89
ACD/BCF (pH 7.4): 17688.02
ACD/KOC (pH 7.4): 38201.07
Polar Surface Area: 0 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 29.2±3.0 dyne/cm
Molar Volume: 237.1±3.0 cm3

Click to predict properties on the Chemicalize site






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