ChemSpider 2D Image | Methyl 5-bromo-2-(~2~H_2_)furancarboxylate | C6H3D2BrO3

Methyl 5-bromo-2-(2H2)furancarboxylate

  • Molecular FormulaC6H3D2BrO3
  • Average mass207.018 Da
  • Monoisotopic mass205.954758 Da
  • ChemSpider ID111332461

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Furan-3,4-d2-carboxylic acid, 5-bromo-, methyl ester [ACD/Index Name]
5-Bromo-2-(2H2)furanecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-bromo-2-(2H2)furancarboxylate [ACD/IUPAC Name]
Methyl-5-brom-2-(2H2)furancarboxylat [German] [ACD/IUPAC 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: 226.3±20.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.3±3.0 kJ/mol
Flash Point: 90.7±21.8 °C
Index of Refraction: 1.514
Molar Refractivity: 38.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 22.93
ACD/KOC (pH 5.5): 327.68
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 22.93
ACD/KOC (pH 7.4): 327.68
Polar Surface Area: 39 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 39.5±3.0 dyne/cm
Molar Volume: 126.3±3.0 cm3

Click to predict properties on the Chemicalize site


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