ChemSpider 2D Image | 2-Methyl(~2~H_6_)propan-2-ol | C4H4D6O

2-Methyl(2H6)propan-2-ol

  • Molecular FormulaC4H4D6O
  • Average mass80.159 Da
  • Monoisotopic mass80.110825 Da
  • ChemSpider ID24532277
  • Non-standard isotope - Non-standard isotope


More details:






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

2-Methyl(2H6)propan-2-ol
2-Methyl-2-(2H6)propanol [ACD/IUPAC Name]
2-Methyl-2-(2H6)propanol [German] [ACD/IUPAC Name]
2-Méthyl-2-(2H6)propanol [French] [ACD/IUPAC Name]
2-Propan-1,1,1,3,3,3-d6-ol, 2-methyl- [ACD/Index Name]
53853-65-9 [RN]
tert-Butanol [Wiki]
TERT-BUTANOL-1,1,1,3,3,3-D6
tert-Butyl-1,1,1,3,3,3-d6 Alcohol

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

Density: 0.8±0.1 g/cm3
Boiling Point: 84.6±8.0 °C at 760 mmHg
Vapour Pressure: 46.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 37.9±6.0 kJ/mol
Flash Point: 11.7±0.0 °C
Index of Refraction: 1.395
Molar Refractivity: 22.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 2.09
ACD/KOC (pH 5.5): 58.95
ACD/LogD (pH 7.4): 0.72
ACD/BCF (pH 7.4): 2.09
ACD/KOC (pH 7.4): 58.95
Polar Surface Area: 20 Å2
Polarizability: 8.8±0.5 10-24cm3
Surface Tension: 23.6±3.0 dyne/cm
Molar Volume: 92.1±3.0 cm3

Click to predict properties on the Chemicalize site


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