ChemSpider 2D Image | MFCD01073966 | C4HD9O

MFCD01073966

  • Molecular FormulaC4HD9O
  • Average mass83.177 Da
  • Monoisotopic mass83.129654 Da
  • ChemSpider ID24532758

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Propan-1,1,2,3,3,3-d6-ol, 2-(methyl-d3)- [ACD/Index Name]
2-(2H3)Methyl(2H6)propan-1-ol
2-(2H3)Methyl-1-(2H6)propanol [German] [ACD/IUPAC Name]
2-(2H3)Methyl-1-(2H6)propanol [ACD/IUPAC Name]
2-(2H3)Méthyl-1-(2H6)propanol [French] [ACD/IUPAC Name]
2-Methyl-1-propan-d9-ol
850209-54-0 [RN]
Isobutan-d9-ol
Isobutyl-d9 alcohol
MFCD01073966
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.8±0.1 g/cm3
Boiling Point: 105.0±8.0 °C at 760 mmHg
Vapour Pressure: 16.4±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.8±0.0 kJ/mol
Flash Point: 27.8±0.0 °C
Index of Refraction: 1.393
Molar Refractivity: 22.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): 0.73
ACD/BCF (pH 5.5): 2.11
ACD/KOC (pH 5.5): 59.44
ACD/LogD (pH 7.4): 0.73
ACD/BCF (pH 7.4): 2.11
ACD/KOC (pH 7.4): 59.44
Polar Surface Area: 20 Å2
Polarizability: 8.8±0.5 10-24cm3
Surface Tension: 24.4±3.0 dyne/cm
Molar Volume: 92.4±3.0 cm3

Click to predict properties on the Chemicalize site


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