ChemSpider 2D Image | Bicyclo[3.2.0]hepta-1,4-dien-3-one | C7H6O

Bicyclo[3.2.0]hepta-1,4-dien-3-one

  • Molecular FormulaC7H6O
  • Average mass106.122 Da
  • Monoisotopic mass106.041862 Da
  • ChemSpider ID35767493

More details:

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

Bicyclo[3.2.0]hepta-1,4-dien-3-on [German] [ACD/IUPAC Name]
Bicyclo[3.2.0]hepta-1,4-dien-3-one [ACD/Index Name] [ACD/IUPAC Name]
Bicyclo[3.2.0]hepta-1,4-dién-3-one [French] [ACD/IUPAC Name]
51577-33-4 [RN]
BICYCLO[3.2.0]HEPTA-1,4,6-TRIEN-3-ONE [ACD/Index Name] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 286.9±7.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.6±3.0 kJ/mol
Flash Point: 125.9±13.1 °C
Index of Refraction: 1.576
Molar Refractivity: 29.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 2.95
ACD/KOC (pH 5.5): 75.43
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 2.95
ACD/KOC (pH 7.4): 75.43
Polar Surface Area: 17 Å2
Polarizability: 11.8±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 90.2±5.0 cm3

Click to predict properties on the Chemicalize site


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