ChemSpider 2D Image | 1-Cyclohexyl-3,3-dimethyl-1-butanone | C12H22O

1-Cyclohexyl-3,3-dimethyl-1-butanone

  • Molecular FormulaC12H22O
  • Average mass182.303 Da
  • Monoisotopic mass182.167068 Da
  • ChemSpider ID44532724

More details:

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

1-Butanone, 1-cyclohexyl-3,3-dimethyl- [ACD/Index Name]
1-Cyclohexyl-3,3-dimethyl-1-butanon [German] [ACD/IUPAC Name]
1-Cyclohexyl-3,3-dimethyl-1-butanone [ACD/IUPAC Name]
1-Cyclohexyl-3,3-diméthyl-1-butanone [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 233.0±8.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.0±3.0 kJ/mol
Flash Point: 105.9±6.1 °C
Index of Refraction: 1.456
Molar Refractivity: 55.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.66
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 336.58
ACD/KOC (pH 5.5): 2241.30
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 336.58
ACD/KOC (pH 7.4): 2241.30
Polar Surface Area: 17 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 30.9±3.0 dyne/cm
Molar Volume: 203.8±3.0 cm3

Click to predict properties on the Chemicalize site


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