ChemSpider 2D Image | 7-Oxobicyclo[4.1.0]hepta-1,3,5-triene-3-carboxylic acid | C8H4O3

7-Oxobicyclo[4.1.0]hepta-1,3,5-triene-3-carboxylic acid

  • Molecular FormulaC8H4O3
  • Average mass148.116 Da
  • Monoisotopic mass148.016037 Da
  • ChemSpider ID24829156

More details:

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

7-Oxobicyclo[4.1.0]hepta-1,3,5-trien-3-carbonsäure [German] [ACD/IUPAC Name]
7-Oxobicyclo[4.1.0]hepta-1,3,5-triene-3-carboxylic acid [ACD/IUPAC Name]
Acide 7-oxobicyclo[4.1.0]hepta-1,3,5-triène-3-carboxylique [French] [ACD/IUPAC Name]
Bicyclo[4.1.0]hepta-1,3,5-triene-3-carboxylic acid, 7-oxo- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 374.4±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.6±3.0 kJ/mol
Flash Point: 194.4±18.6 °C
Index of Refraction: 1.717
Molar Refractivity: 36.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): -0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.23
ACD/LogD (pH 7.4): -1.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 14.4±0.5 10-24cm3
Surface Tension: 83.1±3.0 dyne/cm
Molar Volume: 92.1±3.0 cm3

Click to predict properties on the Chemicalize site


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