ChemSpider 2D Image | 2-[(2-Methyl-2-propanyl)sulfinyl]pentane | C9H20OS

2-[(2-Methyl-2-propanyl)sulfinyl]pentane

  • Molecular FormulaC9H20OS
  • Average mass176.320 Da
  • Monoisotopic mass176.123489 Da
  • ChemSpider ID35766376

More details:






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

2-[(2-Methyl-2-propanyl)sulfinyl]pentan [German] [ACD/IUPAC Name]
2-[(2-Methyl-2-propanyl)sulfinyl]pentane [ACD/IUPAC Name]
2-[(2-Méthyl-2-propanyl)sulfinyl]pentane [French] [ACD/IUPAC Name]
Pentane, 2-[(1,1-dimethylethyl)sulfinyl]- [ACD/Index Name]
2-(2-Methylpropane-2-sulfinyl)pentane
40390-67-8 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 274.4±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 119.8±18.7 °C
Index of Refraction: 1.474
Molar Refractivity: 52.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 20.83
ACD/KOC (pH 5.5): 305.91
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.83
ACD/KOC (pH 7.4): 305.91
Polar Surface Area: 36 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 34.6±3.0 dyne/cm
Molar Volume: 187.0±3.0 cm3

Click to predict properties on the Chemicalize site






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