ChemSpider 2D Image | 3-(Methylsulfonyl)cyclopentyl 2,5-dimethyl-3-furoate | C13H18O5S

3-(Methylsulfonyl)cyclopentyl 2,5-dimethyl-3-furoate

  • Molecular FormulaC13H18O5S
  • Average mass286.344 Da
  • Monoisotopic mass286.087494 Da
  • ChemSpider ID35152022

More details:

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

2,5-Diméthyl-3-furoate de 3-(méthylsulfonyl)cyclopentyle [French] [ACD/IUPAC Name]
3-(Methylsulfonyl)cyclopentyl 2,5-dimethyl-3-furoate [ACD/IUPAC Name]
3-(Methylsulfonyl)cyclopentyl-2,5-dimethyl-3-furoat [German] [ACD/IUPAC Name]
3-Furancarboxylic acid, 2,5-dimethyl-, 3-(methylsulfonyl)cyclopentyl ester [ACD/Index 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: 449.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 225.7±28.7 °C
Index of Refraction: 1.531
Molar Refractivity: 69.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.55
ACD/LogD (pH 5.5): 1.92
ACD/BCF (pH 5.5): 16.90
ACD/KOC (pH 5.5): 263.40
ACD/LogD (pH 7.4): 1.92
ACD/BCF (pH 7.4): 16.90
ACD/KOC (pH 7.4): 263.40
Polar Surface Area: 82 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 46.9±5.0 dyne/cm
Molar Volume: 224.5±5.0 cm3

Click to predict properties on the Chemicalize site


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