ChemSpider 2D Image | 3-(2,2,3,4,4-~2~H_5_)Pentanol | C5H7D5O

3-(2,2,3,4,4-2H5)Pentanol

  • Molecular FormulaC5H7D5O
  • Average mass93.179 Da
  • Monoisotopic mass93.120201 Da
  • ChemSpider ID24533744

  • Non-standard isotope - Non-standard isotope

More details:

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

(2,2,3,4,4-2H5)Pentan-3-ol
3-(2,2,3,4,4-2H5)Pentanol [German] [ACD/IUPAC Name]
3-(2,2,3,4,4-2H5)Pentanol [ACD/IUPAC Name]
3-(2,2,3,4,4-2H5)Pentanol [French] [ACD/IUPAC Name]
3-Pentan-2,2,3,4,4-d5-ol [ACD/Index Name]
144032-75-7 [RN]
14848-79-4 [RN]
3-Pentanol [ACD/Index Name] [ACD/IUPAC Name]
3-Pentyl-2,2,3,4,4-d5 Alcohol
DIETHYL CARBINOL
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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: 115.3±0.0 °C at 760 mmHg
Vapour Pressure: 9.7±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.2±6.0 kJ/mol
Flash Point: 40.6±0.0 °C
Index of Refraction: 1.405
Molar Refractivity: 26.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 6.33
ACD/KOC (pH 5.5): 130.34
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.33
ACD/KOC (pH 7.4): 130.34
Polar Surface Area: 20 Å2
Polarizability: 10.6±0.5 10-24cm3
Surface Tension: 25.7±3.0 dyne/cm
Molar Volume: 109.0±3.0 cm3

Click to predict properties on the Chemicalize site


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