ChemSpider 2D Image | 2-Methyl-2-propane-d9-thiol | C4HD9S

2-Methyl-2-propane-d9-thiol

  • Molecular FormulaC4HD9S
  • Average mass99.243 Da
  • Monoisotopic mass99.106812 Da
  • ChemSpider ID24532752

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(2H3)Methyl(2H6)propane-2-thiol
2-(2H3)Methyl-2-(2H6)propanethiol [ACD/IUPAC Name]
2-(2H3)Méthyl-2-(2H6)propanethiol [French] [ACD/IUPAC Name]
2-(2H3)Methyl-2-(2H6)propanthiol [German] [ACD/IUPAC Name]
2-Methyl-2-propane-d9-thiol
2-Propane-1,1,1,3,3,3-d6-thiol, 2-(methyl-d3)- [ACD/Index Name]
99224-24-5 [RN]
TERT-BUTANETHIOL
tert-Butyl Mercaptan
tert-Butylmercaptan

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

Density: 0.8±0.1 g/cm3
Boiling Point: 67.0±8.0 °C at 760 mmHg
Vapour Pressure: 160.1±0.1 mmHg at 25°C
Enthalpy of Vaporization: 28.5±0.0 kJ/mol
Flash Point: -24.4±0.0 °C
Index of Refraction: 1.437
Molar Refractivity: 28.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.36
ACD/KOC (pH 5.5): 409.95
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.36
ACD/KOC (pH 7.4): 409.91
Polar Surface Area: 39 Å2
Polarizability: 11.3±0.5 10-24cm3
Surface Tension: 23.1±3.0 dyne/cm
Molar Volume: 108.7±3.0 cm3

Click to predict properties on the Chemicalize site


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