ChemSpider 2D Image | 2-(3-Fluoro-4-hydroxyphenyl)-1,3-benzoxazol-5-ol | C13H8FNO3

2-(3-Fluoro-4-hydroxyphenyl)-1,3-benzoxazol-5-ol

  • Molecular FormulaC13H8FNO3
  • Average mass245.206 Da
  • Monoisotopic mass245.048828 Da
  • ChemSpider ID23252504

More details:

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

2-(3-Fluor-4-hydroxyphenyl)-1,3-benzoxazol-5-ol [German] [ACD/IUPAC Name]
2-(3-Fluoro-4-hydroxyphenyl)-1,3-benzoxazol-5-ol [ACD/IUPAC Name]
2-(3-Fluoro-4-hydroxyphényl)-1,3-benzoxazol-5-ol [French] [ACD/IUPAC Name]
5-Benzoxazolol, 2-(3-fluoro-4-hydroxyphenyl)- [ACD/Index Name]
2-(3-Fluoro-4-hydroxy-phenyl)-benzooxazol-5-ol
544704-39-4 [RN]
CHEMBL360817
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL360817/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 408.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.6±3.0 kJ/mol
Flash Point: 200.5±27.3 °C
Index of Refraction: 1.682
Molar Refractivity: 62.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 26.90
ACD/KOC (pH 5.5): 355.37
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 8.43
ACD/KOC (pH 7.4): 111.39
Polar Surface Area: 66 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 165.9±3.0 cm3

Click to predict properties on the Chemicalize site


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