ChemSpider 2D Image | 3-Benzyl-5-fluoro-1,3-benzoxazol-2(3H)-one | C14H10FNO2

3-Benzyl-5-fluoro-1,3-benzoxazol-2(3H)-one

  • Molecular FormulaC14H10FNO2
  • Average mass243.233 Da
  • Monoisotopic mass243.069550 Da
  • ChemSpider ID21495170

More details:






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

2(3H)-Benzoxazolone, 5-fluoro-3-(phenylmethyl)- [ACD/Index Name]
3-Benzyl-5-fluor-1,3-benzoxazol-2(3H)-on [German] [ACD/IUPAC Name]
3-Benzyl-5-fluoro-1,3-benzoxazol-2(3H)-one [ACD/IUPAC Name]
3-Benzyl-5-fluoro-1,3-benzoxazol-2(3H)-one [French] [ACD/IUPAC Name]
3-BENZYL-5-FLUOROBENZO[D]OXAZOL-2(3H)-ONE
924984-41-8 [RN]
MFCD08278499

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 385.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.4±3.0 kJ/mol
Flash Point: 186.9±30.7 °C
Index of Refraction: 1.627
Molar Refractivity: 63.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 3.23
ACD/BCF (pH 5.5): 167.93
ACD/KOC (pH 5.5): 1362.57
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 167.93
ACD/KOC (pH 7.4): 1362.57
Polar Surface Area: 30 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 179.6±3.0 cm3

Click to predict properties on the Chemicalize site






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