ChemSpider 2D Image | Ethyl 2-[4-(methylsulfonyl)phenoxy]butanoate | C13H18O5S

Ethyl 2-[4-(methylsulfonyl)phenoxy]butanoate

  • Molecular FormulaC13H18O5S
  • Average mass286.344 Da
  • Monoisotopic mass286.087494 Da
  • ChemSpider ID45208101

More details:

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

2-[4-(Méthylsulfonyl)phénoxy]butanoate d'éthyle [French] [ACD/IUPAC Name]
Butanoic acid, 2-[4-(methylsulfonyl)phenoxy]-, ethyl ester [ACD/Index Name]
Ethyl 2-[4-(methylsulfonyl)phenoxy]butanoate [ACD/IUPAC Name]
Ethyl-2-[4-(methylsulfonyl)phenoxy]butanoat [German] [ACD/IUPAC Name]
ETHYL 2-(4-METHANESULFONYLPHENOXY)BUTANOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 428.5±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 213.0±27.6 °C
Index of Refraction: 1.504
Molar Refractivity: 71.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 10.61
ACD/KOC (pH 5.5): 188.77
ACD/LogD (pH 7.4): 1.65
ACD/BCF (pH 7.4): 10.61
ACD/KOC (pH 7.4): 188.77
Polar Surface Area: 78 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 39.5±3.0 dyne/cm
Molar Volume: 241.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement