ChemSpider 2D Image | (1,1-~2~H_2_)-2-Octyn-1-ol | C8H12D2O

(1,1-2H2)-2-Octyn-1-ol

  • Molecular FormulaC8H12D2O
  • Average mass128.208 Da
  • Monoisotopic mass128.117020 Da
  • ChemSpider ID62767515

  • Non-standard isotope - Non-standard isotope

More details:

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

(1,1-2H2)-2-Octin-1-ol [German] [ACD/IUPAC Name]
(1,1-2H2)-2-Octyn-1-ol [ACD/IUPAC Name]
(1,1-2H2)-2-Octyn-1-ol [French] [ACD/IUPAC Name]
2-Octyn-1,1-d2-1-ol [ACD/Index Name]
144401-62-7 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 152.5±8.0 °C at 760 mmHg
Vapour Pressure: 1.3±0.6 mmHg at 25°C
Enthalpy of Vaporization: 45.3±6.0 kJ/mol
Flash Point: 51.7±11.4 °C
Index of Refraction: 1.459
Molar Refractivity: 38.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 26.96
ACD/KOC (pH 5.5): 367.92
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.96
ACD/KOC (pH 7.4): 367.92
Polar Surface Area: 20 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 141.4±3.0 cm3

Click to predict properties on the Chemicalize site


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