ChemSpider 2D Image | 5-Methyl-4-hepten-3-one | C8H14O

5-Methyl-4-hepten-3-one

  • Molecular FormulaC8H14O
  • Average mass126.196 Da
  • Monoisotopic mass126.104462 Da
  • ChemSpider ID23254829

More details:

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

4-Hepten-3-one, 5-methyl- [ACD/Index Name]
5-Methyl-4-hepten-3-on [German] [ACD/IUPAC Name]
5-Methyl-4-hepten-3-one [ACD/IUPAC Name]
5-Méthyl-4-heptén-3-one [French] [ACD/IUPAC Name]
5-methylhept-4-en-3-one
1447-26-3 [RN]
20685-44-3 [RN]
3-Methyl-3-hepten-5-one
hept-4-en-3-one, 5-methyl-

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

Density: 0.8±0.1 g/cm3
Boiling Point: 166.5±0.0 °C at 760 mmHg
Vapour Pressure: 1.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.3±3.0 kJ/mol
Flash Point: 59.9±11.9 °C
Index of Refraction: 1.430
Molar Refractivity: 39.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.38
ACD/KOC (pH 5.5): 311.66
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.38
ACD/KOC (pH 7.4): 311.66
Polar Surface Area: 17 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 25.3±3.0 dyne/cm
Molar Volume: 151.1±3.0 cm3

Click to predict properties on the Chemicalize site


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