ChemSpider 2D Image | 6-Chloro-3-phenyl-1-benzofuran-2-carboxylic acid | C15H9ClO3

6-Chloro-3-phenyl-1-benzofuran-2-carboxylic acid

  • Molecular FormulaC15H9ClO3
  • Average mass272.683 Da
  • Monoisotopic mass272.024017 Da
  • ChemSpider ID26053263

More details:

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

1208402-13-4 [RN]
2-Benzofurancarboxylic acid, 6-chloro-3-phenyl- [ACD/Index Name]
6-Chlor-3-phenyl-1-benzofuran-2-carbonsäure [German] [ACD/IUPAC Name]
6-Chloro-3-phenyl-1-benzofuran-2-carboxylic acid [ACD/IUPAC Name]
Acide 6-chloro-3-phényl-1-benzofurane-2-carboxylique [French] [ACD/IUPAC Name]
MFCD13196283 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 426.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 211.5±28.7 °C
Index of Refraction: 1.665
Molar Refractivity: 72.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 2.13
ACD/KOC (pH 5.5): 8.95
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 1.21
ACD/KOC (pH 7.4): 5.09
Polar Surface Area: 50 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 196.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement