ChemSpider 2D Image | 2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-2,5-heptadien-4-one | C15H22O

2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-2,5-heptadien-4-one

  • Molecular FormulaC15H22O
  • Average mass218.335 Da
  • Monoisotopic mass218.167068 Da
  • ChemSpider ID23351319

More details:

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

2,5-Heptadien-4-one, 2-methyl-6-(4-methyl-3-cyclohexen-1-yl)- [ACD/Index Name]
2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-2,5-heptadien-4-on [German] [ACD/IUPAC Name]
2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-2,5-heptadien-4-one [ACD/IUPAC Name]
2-Méthyl-6-(4-méthyl-3-cyclohexén-1-yl)-2,5-heptadién-4-one [French] [ACD/IUPAC Name]
2-Methyl-6-(4-methylcyclohex-3-en-1-yl)hepta-2,5-dien-4-one
532-64-9 [RN]
2-methyl-6-(4-methyl-3-cyclohexen-1-yl)hepta-2,5-dien-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: 321.1±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.3±3.0 kJ/mol
Flash Point: 133.6±17.0 °C
Index of Refraction: 1.497
Molar Refractivity: 68.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1183.89
ACD/KOC (pH 5.5): 5514.12
ACD/LogD (pH 7.4): 4.35
ACD/BCF (pH 7.4): 1183.89
ACD/KOC (pH 7.4): 5514.12
Polar Surface Area: 17 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 31.4±3.0 dyne/cm
Molar Volume: 234.9±3.0 cm3

Click to predict properties on the Chemicalize site


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