ChemSpider 2D Image | 5-(~2~H_2_)Methylene-1,3-cyclohexadiene | C7H6D2

5-(2H2)Methylene-1,3-cyclohexadiene

  • Molecular FormulaC7H6D2
  • Average mass94.151 Da
  • Monoisotopic mass94.075157 Da
  • ChemSpider ID95664036
  • Non-standard isotope - Non-standard isotope


More details:






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

1,3-Cyclohexadiene, 5-(methylene-d2)- [ACD/Index Name]
5-(2H2)Methylen-1,3-cyclohexadien [German] [ACD/IUPAC Name]
5-(2H2)Methylene-1,3-cyclohexadiene [ACD/IUPAC Name]
5-(2H2)Méthylène-1,3-cyclohexadiène [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 123.0±7.0 °C at 760 mmHg
Vapour Pressure: 16.4±0.1 mmHg at 25°C
Enthalpy of Vaporization: 34.6±0.8 kJ/mol
Flash Point: 6.2±13.0 °C
Index of Refraction: 1.506
Molar Refractivity: 31.8±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 63.60
ACD/KOC (pH 5.5): 679.99
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 63.60
ACD/KOC (pH 7.4): 679.99
Polar Surface Area: 0 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 25.9±5.0 dyne/cm
Molar Volume: 107.0±5.0 cm3

Click to predict properties on the Chemicalize site






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