ChemSpider 2D Image | 2-[(S)-Isopropylsulfinyl]-2-methylpropane | C7H16OS

2-[(S)-Isopropylsulfinyl]-2-methylpropane

  • Molecular FormulaC7H16OS
  • Average mass148.266 Da
  • Monoisotopic mass148.092178 Da
  • ChemSpider ID26496551
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

2-[(S)-Isopropylsulfinyl]-2-methylpropan [German] [ACD/IUPAC Name]
2-[(S)-Isopropylsulfinyl]-2-methylpropane [ACD/IUPAC Name]
2-[(S)-Isopropylsulfinyl]-2-méthylpropane [French] [ACD/IUPAC Name]
Propane, 2-methyl-2-[(S)-[(1S)-1-methylethyl]sulfinyl]- [ACD/Index Name]
(S)-tert-Butyl isopropylsulfoxide
120982-99-2 [RN]
2-[(S)-2-METHYLPROPANE-2-SULFINYL]PROPANE
MFCD11707186

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

Density: 1.0±0.1 g/cm3
Boiling Point: 238.7±9.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 45.6±3.0 kJ/mol
Flash Point: 98.2±18.7 °C
Index of Refraction: 1.474
Molar Refractivity: 43.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 5.07
ACD/KOC (pH 5.5): 111.29
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 5.07
ACD/KOC (pH 7.4): 111.29
Polar Surface Area: 36 Å2
Polarizability: 17.2±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 154.0±3.0 cm3

Click to predict properties on the Chemicalize site






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