ChemSpider 2D Image | (5S)-5-(3-Fluorophenyl)-4,5-dihydro-1,2-oxazole-3-carboxylic acid | C10H8FNO3

(5S)-5-(3-Fluorophenyl)-4,5-dihydro-1,2-oxazole-3-carboxylic acid

  • Molecular FormulaC10H8FNO3
  • Average mass209.174 Da
  • Monoisotopic mass209.048828 Da
  • ChemSpider ID67966330

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-5-(3-Fluorophenyl)-4,5-dihydro-1,2-oxazole-3-carboxylic acid [ACD/IUPAC Name]
(5S)-5-(3-Fluorphenyl)-4,5-dihydro-1,2-oxazol-3-carbonsäure [German] [ACD/IUPAC Name]
3-Isoxazolecarboxylic acid, 5-(3-fluorophenyl)-4,5-dihydro-, (5S)- [ACD/Index Name]
Acide (5S)-5-(3-fluorophényl)-4,5-dihydro-1,2-oxazole-3-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 348.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.6±3.0 kJ/mol
Flash Point: 164.5±30.7 °C
Index of Refraction: 1.598
Molar Refractivity: 49.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 145.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement