ChemSpider 2D Image | 4-Hydroxy-6-methyl-2-cyclohexen-1-one | C7H10O2

4-Hydroxy-6-methyl-2-cyclohexen-1-one

  • Molecular FormulaC7H10O2
  • Average mass126.153 Da
  • Monoisotopic mass126.068077 Da
  • ChemSpider ID24611774

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

2-Cyclohexen-1-one, 4-hydroxy-6-methyl- [ACD/Index Name]
4-Hydroxy-6-methyl-2-cyclohexen-1-on [German] [ACD/IUPAC Name]
4-Hydroxy-6-methyl-2-cyclohexen-1-one [ACD/IUPAC Name]
4-Hydroxy-6-méthyl-2-cyclohexén-1-one [French] [ACD/IUPAC Name]
1404477-37-7 [RN]
AMPELOMIN A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 251.3±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 56.8±6.0 kJ/mol
Flash Point: 103.6±19.7 °C
Index of Refraction: 1.507
Molar Refractivity: 33.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.37
ACD/LogD (pH 5.5): 0.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 33.01
ACD/LogD (pH 7.4): 0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 33.01
Polar Surface Area: 37 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 113.2±3.0 cm3

Click to predict properties on the Chemicalize site


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