ChemSpider 2D Image | Ethyl 3-(4-chloro-3-fluorophenyl)-3-hydroxypropanoate | C11H12ClFO3

Ethyl 3-(4-chloro-3-fluorophenyl)-3-hydroxypropanoate

  • Molecular FormulaC11H12ClFO3
  • Average mass246.663 Da
  • Monoisotopic mass246.045898 Da
  • ChemSpider ID40655246

More details:

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

3-(4-Chloro-3-fluorophényl)-3-hydroxypropanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-chloro-3-fluoro-β-hydroxy-, ethyl ester [ACD/Index Name]
Ethyl 3-(4-chloro-3-fluorophenyl)-3-hydroxypropanoate [ACD/IUPAC Name]
Ethyl-3-(4-chlor-3-fluorphenyl)-3-hydroxypropanoat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 351.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.9±3.0 kJ/mol
Flash Point: 166.2±26.5 °C
Index of Refraction: 1.523
Molar Refractivity: 57.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 33.16
ACD/KOC (pH 5.5): 426.63
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 33.16
ACD/KOC (pH 7.4): 426.63
Polar Surface Area: 47 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 189.7±3.0 cm3

Click to predict properties on the Chemicalize site


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