ChemSpider 2D Image | 1-(2,2-Dimethyl-6-methylenecyclohexyl)-2-buten-1-one | C13H20O

1-(2,2-Dimethyl-6-methylenecyclohexyl)-2-buten-1-one

  • Molecular FormulaC13H20O
  • Average mass192.297 Da
  • Monoisotopic mass192.151413 Da
  • ChemSpider ID23350894

More details:

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

1-(2,2-Dimethyl-6-methylencyclohexyl)-2-buten-1-on [German] [ACD/IUPAC Name]
1-(2,2-Dimethyl-6-methylenecyclohexyl)-2-buten-1-one [ACD/IUPAC Name]
1-(2,2-Diméthyl-6-méthylènecyclohexyl)-2-butén-1-one [French] [ACD/IUPAC Name]
1-(2,2-Dimethyl-6-methylenecyclohexyl)but-2-en-1-one
2-Buten-1-one, 1-(2,2-dimethyl-6-methylenecyclohexyl)- [ACD/Index Name]
35087-49-1 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 267.8±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.6±3.0 kJ/mol
Flash Point: 106.1±19.2 °C
Index of Refraction: 1.478
Molar Refractivity: 59.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 3.43
ACD/BCF (pH 5.5): 237.96
ACD/KOC (pH 5.5): 1748.66
ACD/LogD (pH 7.4): 3.43
ACD/BCF (pH 7.4): 237.96
ACD/KOC (pH 7.4): 1748.66
Polar Surface Area: 17 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 29.9±5.0 dyne/cm
Molar Volume: 211.1±5.0 cm3

Click to predict properties on the Chemicalize site


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