ChemSpider 2D Image | Cyclohexyl 5-[(methylsulfonyl)methyl]-2-furoate | C13H18O5S

Cyclohexyl 5-[(methylsulfonyl)methyl]-2-furoate

  • Molecular FormulaC13H18O5S
  • Average mass286.344 Da
  • Monoisotopic mass286.087494 Da
  • ChemSpider ID30210040

More details:

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

2-Furancarboxylic acid, 5-[(methylsulfonyl)methyl]-, cyclohexyl ester [ACD/Index Name]
5-[(Méthylsulfonyl)méthyl]-2-furoate de cyclohexyle [French] [ACD/IUPAC Name]
Cyclohexyl 5-[(methylsulfonyl)methyl]-2-furoate [ACD/IUPAC Name]
Cyclohexyl-5-[(methylsulfonyl)methyl]-2-furoat [German] [ACD/IUPAC Name]
CYCLOHEXYL 5-(METHANESULFONYLMETHYL)FURAN-2-CARBOXYLATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 485.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 247.5±27.3 °C
Index of Refraction: 1.532
Molar Refractivity: 69.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.71
ACD/KOC (pH 5.5): 249.94
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.71
ACD/KOC (pH 7.4): 249.94
Polar Surface Area: 82 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 48.3±5.0 dyne/cm
Molar Volume: 224.3±5.0 cm3

Click to predict properties on the Chemicalize site


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