ChemSpider 2D Image | (5,5,6,6,6-~2~H_5_)-3-Hexyn-1-ol | C6H5D5O

(5,5,6,6,6-2H5)-3-Hexyn-1-ol

  • Molecular FormulaC6H5D5O
  • Average mass103.174 Da
  • Monoisotopic mass103.104546 Da
  • ChemSpider ID107440936

  • Non-standard isotope - Non-standard isotope

More details:

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

(5,5,6,6,6-2H5)-3-Hexin-1-ol [German] [ACD/IUPAC Name]
(5,5,6,6,6-2H5)-3-Hexyn-1-ol [ACD/IUPAC Name]
(5,5,6,6,6-2H5)-3-Hexyn-1-ol [French] [ACD/IUPAC Name]
3-Hexyn-5,5,6,6,6-d5-1-ol [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 158.9±0.0 °C at 760 mmHg
Vapour Pressure: 0.9±0.6 mmHg at 25°C
Enthalpy of Vaporization: 46.1±6.0 kJ/mol
Flash Point: 63.3±0.0 °C
Index of Refraction: 1.455
Molar Refractivity: 29.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.99
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 3.67
ACD/KOC (pH 5.5): 88.29
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.67
ACD/KOC (pH 7.4): 88.29
Polar Surface Area: 20 Å2
Polarizability: 11.6±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 108.4±3.0 cm3

Click to predict properties on the Chemicalize site


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