ChemSpider 2D Image | Methyl 7-[(~2~H_3_)methyloxy]-1,3-benzodioxole-5-carboxylate | C10H7D3O5

Methyl 7-[(2H3)methyloxy]-1,3-benzodioxole-5-carboxylate

  • Molecular FormulaC10H7D3O5
  • Average mass213.202 Da
  • Monoisotopic mass213.071655 Da
  • ChemSpider ID107433469

  • Non-standard isotope - Non-standard isotope

More details:

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

1,3-Benzodioxole-5-carboxylic acid, 7-(methyl-d3-oxy)-, methyl ester [ACD/Index Name]
7-[(2H3)Méthyloxy]-1,3-benzodioxole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 7-[(2H3)methyloxy]-1,3-benzodioxole-5-carboxylate [ACD/IUPAC Name]
Methyl-7-[(2H3)methyloxy]-1,3-benzodioxol-5-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: 311.0±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.2±3.0 kJ/mol
Flash Point: 137.0±26.5 °C
Index of Refraction: 1.538
Molar Refractivity: 50.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 11.54
ACD/KOC (pH 5.5): 200.43
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 11.54
ACD/KOC (pH 7.4): 200.43
Polar Surface Area: 54 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 162.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement