ChemSpider 2D Image | 3-(Decylsulfonyl)butanoic acid | C14H28O4S

3-(Decylsulfonyl)butanoic acid

  • Molecular FormulaC14H28O4S
  • Average mass292.435 Da
  • Monoisotopic mass292.170837 Da
  • ChemSpider ID71504947

More details:

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

3-(Decylsulfonyl)butanoic acid [ACD/IUPAC Name]
3-(Decylsulfonyl)butansäure [German] [ACD/IUPAC Name]
Acide 3-(décylsulfonyl)butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 3-(decylsulfonyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 465.8±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 79.7±6.0 kJ/mol
Flash Point: 235.5±24.0 °C
Index of Refraction: 1.473
Molar Refractivity: 77.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 15.56
ACD/KOC (pH 5.5): 83.54
ACD/LogD (pH 7.4): 0.72
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.75
Polar Surface Area: 80 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 275.7±3.0 cm3

Click to predict properties on the Chemicalize site


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