ChemSpider 2D Image | 2-Oxotetrahydro-3-furanyl 4-(cyclopentylsulfonyl)benzoate | C16H18O6S

2-Oxotetrahydro-3-furanyl 4-(cyclopentylsulfonyl)benzoate

  • Molecular FormulaC16H18O6S
  • Average mass338.375 Da
  • Monoisotopic mass338.082397 Da
  • ChemSpider ID32053993

More details:






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

2-Oxotetrahydro-3-furanyl 4-(cyclopentylsulfonyl)benzoate [ACD/IUPAC Name]
2-Oxotetrahydro-3-furanyl-4-(cyclopentylsulfonyl)benzoat [German] [ACD/IUPAC Name]
4-(Cyclopentylsulfonyl)benzoate de 2-oxotétrahydro-3-furanyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(cyclopentylsulfonyl)-, tetrahydro-2-oxo-3-furanyl ester [ACD/Index Name]
2-OXOOXOLAN-3-YL 4-(CYCLOPENTANESULFONYL)BENZOATE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 590.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 311.0±30.1 °C
Index of Refraction: 1.585
Molar Refractivity: 81.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.23
ACD/KOC (pH 5.5): 97.74
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.23
ACD/KOC (pH 7.4): 97.74
Polar Surface Area: 95 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 57.8±5.0 dyne/cm
Molar Volume: 243.0±5.0 cm3

Click to predict properties on the Chemicalize site






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