ChemSpider 2D Image | 2-(Decylsulfanyl)-2-methylpropanoic acid | C14H28O2S

2-(Decylsulfanyl)-2-methylpropanoic acid

  • Molecular FormulaC14H28O2S
  • Average mass260.436 Da
  • Monoisotopic mass260.181000 Da
  • ChemSpider ID30801278

More details:

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

2-(Decylsulfanyl)-2-methylpropanoic acid [ACD/IUPAC Name]
2-(Decylsulfanyl)-2-methylpropansäure [German] [ACD/IUPAC Name]
Acide 2-(décylsulfanyl)-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 2-(decylthio)-2-methyl- [ACD/Index Name]
1402128-31-7 [RN]
2-(decylthio)-2-methylpropanoic acid
MFCD23538262

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

Density: 1.0±0.1 g/cm3
Boiling Point: 363.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 173.8±23.2 °C
Index of Refraction: 1.482
Molar Refractivity: 76.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 238.73
ACD/KOC (pH 5.5): 586.56
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 5.04
ACD/KOC (pH 7.4): 12.39
Polar Surface Area: 63 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 268.3±3.0 cm3

Click to predict properties on the Chemicalize site


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