ChemSpider 2D Image | 2,7,7-Trimethyl-2,4-cycloheptadien-1-one | C10H14O

2,7,7-Trimethyl-2,4-cycloheptadien-1-one

  • Molecular FormulaC10H14O
  • Average mass150.218 Da
  • Monoisotopic mass150.104462 Da
  • ChemSpider ID60824963

More details:

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

2,4-Cycloheptadien-1-one, 2,7,7-trimethyl- [ACD/Index Name]
2,7,7-Trimethyl-2,4-cycloheptadien-1-on [German] [ACD/IUPAC Name]
2,7,7-Trimethyl-2,4-cycloheptadien-1-one [ACD/IUPAC Name]
2,7,7-Triméthyl-2,4-cycloheptadién-1-one [French] [ACD/IUPAC Name]
37459-89-5 [RN]
MFCD24701132

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

Density: 0.9±0.1 g/cm3
Boiling Point: 226.9±10.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.3±3.0 kJ/mol
Flash Point: 90.3±9.8 °C
Index of Refraction: 1.470
Molar Refractivity: 45.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 2.25
ACD/BCF (pH 5.5): 30.17
ACD/KOC (pH 5.5): 398.74
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.17
ACD/KOC (pH 7.4): 398.74
Polar Surface Area: 17 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 27.2±3.0 dyne/cm
Molar Volume: 163.7±3.0 cm3

Click to predict properties on the Chemicalize site


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