ChemSpider 2D Image | 2-(~2~H_5_)Ethyl-1-hexanol | C8H13D5O

2-(2H5)Ethyl-1-hexanol

  • Molecular FormulaC8H13D5O
  • Average mass135.259 Da
  • Monoisotopic mass135.167145 Da
  • ChemSpider ID8233117

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Hexanol, 2-(ethyl-d5)- [ACD/Index Name]
2-(2H5)Ethyl-1-hexanol [ACD/IUPAC Name]
2-(2H5)Ethyl-1-hexanol [German] [ACD/IUPAC Name]
2-(2H5)Éthyl-1-hexanol [French] [ACD/IUPAC Name]
145395-65-9 [RN]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 184.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.7 mmHg at 25°C
Enthalpy of Vaporization: 49.0±6.0 kJ/mol
Flash Point: 77.2±0.0 °C
Index of Refraction: 1.426
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 48.38
ACD/KOC (pH 5.5): 559.10
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 48.38
ACD/KOC (pH 7.4): 559.10
Polar Surface Area: 20 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 28.0±3.0 dyne/cm
Molar Volume: 158.5±3.0 cm3

Click to predict properties on the Chemicalize site


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