ChemSpider 2D Image | Turmerone | C15H22O

Turmerone

  • Molecular FormulaC15H22O
  • Average mass218.335 Da
  • Monoisotopic mass218.167068 Da
  • ChemSpider ID30791650

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(6S)-2-Methyl-6-(4-methyl-1,4-cyclohexadien-1-yl)-2-hepten-4-on [German] [ACD/IUPAC Name]
(6S)-2-Methyl-6-(4-methyl-1,4-cyclohexadien-1-yl)-2-hepten-4-one [ACD/IUPAC Name]
(6S)-2-Méthyl-6-(4-méthyl-1,4-cyclohexadién-1-yl)-2-heptén-4-one [French] [ACD/IUPAC Name]
2-Hepten-4-one, 2-methyl-6-(4-methyl-1,4-cyclohexadien-1-yl)-, (6S)- [ACD/Index Name]
Turmerone
α-Turmerone
(6S)-2-Methyl-6-(4-methylcyclohexa-1,4-dien-1-yl)hept-2-en-4-one

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 317.6±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.9±3.0 kJ/mol
Flash Point: 139.8±15.3 °C
Index of Refraction: 1.497
Molar Refractivity: 68.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 878.11
ACD/KOC (pH 5.5): 4452.38
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 878.11
ACD/KOC (pH 7.4): 4452.38
Polar Surface Area: 17 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 234.2±3.0 cm3

Click to predict properties on the Chemicalize site


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