ChemSpider 2D Image | Methyl 2-(2-ethoxy-1,1-difluoro-2-oxoethyl)benzoate | C12H12F2O4

Methyl 2-(2-ethoxy-1,1-difluoro-2-oxoethyl)benzoate

  • Molecular FormulaC12H12F2O4
  • Average mass258.218 Da
  • Monoisotopic mass258.070374 Da
  • ChemSpider ID58800083

More details:

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

1835726-67-4 [RN]
2-(2-Éthoxy-1,1-difluoro-2-oxoéthyl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, α,α-difluoro-2-(methoxycarbonyl)-, ethyl ester [ACD/Index Name]
Methyl 2-(2-ethoxy-1,1-difluoro-2-oxoethyl)benzoate [ACD/IUPAC Name]
Methyl-2-(2-ethoxy-1,1-difluor-2-oxoethyl)benzoat [German] [ACD/IUPAC Name]
Ccoc(=O)C(F)(F)C1=C(C=CC=C1)C(=O)OC
MFCD28039123

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

Density: 1.2±0.1 g/cm3
Boiling Point: 326.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.9±3.0 kJ/mol
Flash Point: 146.2±22.8 °C
Index of Refraction: 1.474
Molar Refractivity: 58.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 84.85
ACD/KOC (pH 5.5): 835.88
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 84.85
ACD/KOC (pH 7.4): 835.88
Polar Surface Area: 53 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 34.2±3.0 dyne/cm
Molar Volume: 208.4±3.0 cm3

Click to predict properties on the Chemicalize site


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