ChemSpider 2D Image | 5-Bromo-1-oxo-1H-indene-3-carboxylic acid | C10H5BrO3

5-Bromo-1-oxo-1H-indene-3-carboxylic acid

  • Molecular FormulaC10H5BrO3
  • Average mass253.049 Da
  • Monoisotopic mass251.942200 Da
  • ChemSpider ID60970999

More details:

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

1H-Indene-3-carboxylic acid, 5-bromo-1-oxo- [ACD/Index Name]
5-Brom-1-oxo-1H-inden-3-carbonsäure [German] [ACD/IUPAC Name]
5-Bromo-1-oxo-1H-indene-3-carboxylic acid [ACD/IUPAC Name]
Acide 5-bromo-1-oxo-1H-indène-3-carboxylique [French] [ACD/IUPAC Name]
1388226-12-7 [RN]
MFCD24843622

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

Density: 1.9±0.1 g/cm3
Boiling Point: 385.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.9±3.0 kJ/mol
Flash Point: 186.7±27.9 °C
Index of Refraction: 1.698
Molar Refractivity: 52.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.83
ACD/LogD (pH 5.5): -0.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 73.8±3.0 dyne/cm
Molar Volume: 134.7±3.0 cm3

Click to predict properties on the Chemicalize site


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