ChemSpider 2D Image | 2-Methylbicyclo[3.1.0]hexa-1,3,5-triene | C7H6

2-Methylbicyclo[3.1.0]hexa-1,3,5-triene

  • Molecular FormulaC7H6
  • Average mass90.122 Da
  • Monoisotopic mass90.046951 Da
  • ChemSpider ID35778959

More details:

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

2-Methylbicyclo[3.1.0]hexa-1,3,5-trien [German] [ACD/IUPAC Name]
2-Methylbicyclo[3.1.0]hexa-1,3,5-triene [ACD/IUPAC Name]
2-Méthylbicyclo[3.1.0]hexa-1,3,5-triène [French] [ACD/IUPAC Name]
Bicyclo[3.1.0]hexa-1,3,5-triene, 2-methyl- [ACD/Index Name]
62667-54-3 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 246.8±7.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 46.4±0.8 kJ/mol
Flash Point: 63.5±13.0 °C
Index of Refraction: 1.600
Molar Refractivity: 29.4±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.24
ACD/KOC (pH 5.5): 310.14
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.24
ACD/KOC (pH 7.4): 310.14
Polar Surface Area: 0 Å2
Polarizability: 11.7±0.5 10-24cm3
Surface Tension: 31.0±5.0 dyne/cm
Molar Volume: 86.0±5.0 cm3

Click to predict properties on the Chemicalize site


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