ChemSpider 2D Image | Methyl 3-bromo-2-furoate | C6H5BrO3

Methyl 3-bromo-2-furoate

  • Molecular FormulaC6H5BrO3
  • Average mass205.006 Da
  • Monoisotopic mass203.942200 Da
  • ChemSpider ID30800229

More details:

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

2-Furancarboxylic acid, 3-bromo-, methyl ester [ACD/Index Name]
3-Bromo-2-furoate de méthyle [French] [ACD/IUPAC Name]
59862-77-0 [RN]
Methyl 3-bromo-2-furoate [ACD/IUPAC Name]
methyl 3-bromofuran-2-carboxylate
Methyl-3-brom-2-furoat [German] [ACD/IUPAC Name]
MFCD26402047

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

Density: 1.6±0.1 g/cm3
Boiling Point: 224.2±20.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.1±3.0 kJ/mol
Flash Point: 89.4±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: 1.37
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 19.09
ACD/KOC (pH 5.5): 287.41
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.09
ACD/KOC (pH 7.4): 287.41
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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