ChemSpider 2D Image | 2,3-Dihydroxy(~2~H_5_)propyl acetate | C5H5D5O4

2,3-Dihydroxy(2H5)propyl acetate

  • Molecular FormulaC5H5D5O4
  • Average mass139.161 Da
  • Monoisotopic mass139.089294 Da
  • ChemSpider ID107433827

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2,3-Propane-d5-triol, 1-acetate [ACD/Index Name]
2,3-Dihydroxy(2H5)propyl acetate [ACD/IUPAC Name]
2,3-Dihydroxy(2H5)propyl-acetat [German] [ACD/IUPAC Name]
Acétate de 2,3-dihydroxy(2H5)propyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 253.0±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 57.0±6.0 kJ/mol
Flash Point: 107.3±15.3 °C
Index of Refraction: 1.458
Molar Refractivity: 30.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.27
ACD/LogD (pH 5.5): -0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.22
ACD/LogD (pH 7.4): -0.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.22
Polar Surface Area: 67 Å2
Polarizability: 11.9±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 109.9±3.0 cm3

Click to predict properties on the Chemicalize site


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