ChemSpider 2D Image | Ethyl 2-{[(3,4-difluorophenyl)sulfanyl]methyl}acrylate | C12H12F2O2S

Ethyl 2-{[(3,4-difluorophenyl)sulfanyl]methyl}acrylate

  • Molecular FormulaC12H12F2O2S
  • Average mass258.284 Da
  • Monoisotopic mass258.052612 Da
  • ChemSpider ID44280324

More details:

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

2-{[(3,4-Difluorophényl)sulfanyl]méthyl}acrylate d'éthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 2-[[(3,4-difluorophenyl)thio]methyl]-, ethyl ester [ACD/Index Name]
Ethyl 2-{[(3,4-difluorophenyl)sulfanyl]methyl}acrylate [ACD/IUPAC Name]
Ethyl-2-{[(3,4-difluorphenyl)sulfanyl]methyl}acrylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 307.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 139.8±27.9 °C
Index of Refraction: 1.521
Molar Refractivity: 64.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 390.67
ACD/KOC (pH 5.5): 2493.56
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 390.67
ACD/KOC (pH 7.4): 2493.56
Polar Surface Area: 52 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 37.8±5.0 dyne/cm
Molar Volume: 210.6±5.0 cm3

Click to predict properties on the Chemicalize site


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