ChemSpider 2D Image | Methyl (2,6-~2~H_2_)-7-oxabicyclo[4.1.0]hepta-2,4-diene-1-carboxylate | C8H6D2O3

Methyl (2,6-2H2)-7-oxabicyclo[4.1.0]hepta-2,4-diene-1-carboxylate

  • Molecular FormulaC8H6D2O3
  • Average mass154.160 Da
  • Monoisotopic mass154.059891 Da
  • ChemSpider ID74114742

  • Non-standard isotope - Non-standard isotope

More details:

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

(2,6-2H2)-7-Oxabicyclo[4.1.0]hepta-2,4-diène-1-carboxylate de méthyle [French] [ACD/IUPAC Name]
7-Oxabicyclo[4.1.0]hepta-2,4-diene-2,6-d2-1-carboxylic acid, methyl ester [ACD/Index Name]
Methyl (2,6-2H2)-7-oxabicyclo[4.1.0]hepta-2,4-diene-1-carboxylate [ACD/IUPAC Name]
Methyl-(2,6-2H2)-7-oxabicyclo[4.1.0]hepta-2,4-dien-1-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 205.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.2±3.0 kJ/mol
Flash Point: 77.3±21.9 °C
Index of Refraction: 1.562
Molar Refractivity: 37.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.52
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 2.20
ACD/KOC (pH 5.5): 61.29
ACD/LogD (pH 7.4): 0.75
ACD/BCF (pH 7.4): 2.20
ACD/KOC (pH 7.4): 61.29
Polar Surface Area: 39 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 115.2±3.0 cm3

Click to predict properties on the Chemicalize site


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