ChemSpider 2D Image | 2-Methyl-2-propanyl 2-methyl-2-propanesulfinate | C8H18O2S

2-Methyl-2-propanyl 2-methyl-2-propanesulfinate

  • Molecular FormulaC8H18O2S
  • Average mass178.292 Da
  • Monoisotopic mass178.102753 Da
  • ChemSpider ID21415177

More details:

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

2-Méthyl-2-propanesulfinate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-methyl-2-propanesulfinate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-methyl-2-propansulfinat [German] [ACD/IUPAC Name]
2-Propanesulfinic acid, 2-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
112896-48-7 [RN]
MFCD26408181 [MDL number]
tert-Butyl 2-methylpropane-2-sulfinate
tert-Butyl tert-butanethiosulfinate
tert-Butyl tert-butanethiosulfinate|tert-Butyl 2-methylpropane-2-sulfinate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 228.1±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.6±3.0 kJ/mol
Flash Point: 91.8±22.6 °C
Index of Refraction: 1.474
Molar Refractivity: 49.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.14
ACD/KOC (pH 5.5): 309.07
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.14
ACD/KOC (pH 7.4): 309.07
Polar Surface Area: 46 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 176.6±3.0 cm3

Click to predict properties on the Chemicalize site


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