ChemSpider 2D Image | 1-[(2-Methyl-2-propanyl)sulfinyl]butane | C8H18OS

1-[(2-Methyl-2-propanyl)sulfinyl]butane

  • Molecular FormulaC8H18OS
  • Average mass162.293 Da
  • Monoisotopic mass162.107834 Da
  • ChemSpider ID21412949

More details:






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

1-[(2-Methyl-2-propanyl)sulfinyl]butan [German] [ACD/IUPAC Name]
1-[(2-Methyl-2-propanyl)sulfinyl]butane [ACD/IUPAC Name]
1-[(2-Méthyl-2-propanyl)sulfinyl]butane [French] [ACD/IUPAC Name]
Butane, 1-[(1,1-dimethylethyl)sulfinyl]- [ACD/Index Name]
1-(2-METHYLPROPANE-2-SULFINYL)BUTANE
13153-04-3 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 263.4±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.1±3.0 kJ/mol
Flash Point: 113.1±18.7 °C
Index of Refraction: 1.475
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.47
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.36
ACD/KOC (pH 5.5): 198.22
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 11.36
ACD/KOC (pH 7.4): 198.22
Polar Surface Area: 36 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 170.1±3.0 cm3

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