ChemSpider 2D Image | (1,1,1,2,2,3-~2~H_6_)Octane | C8H12D6

(1,1,1,2,2,3-2H6)Octane

  • Molecular FormulaC8H12D6
  • Average mass120.266 Da
  • Monoisotopic mass120.178513 Da
  • ChemSpider ID67169844

  • Non-standard isotope - Non-standard isotope

More details:

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

(1,1,1,2,2,3-2H6)Octan [German] [ACD/IUPAC Name]
(1,1,1,2,2,3-2H6)Octane [ACD/IUPAC Name]
(1,1,1,2,2,3-2H6)Octane [French] [ACD/IUPAC Name]
Octane-1,1,1,2,2,3-d6 [ACD/Index Name]
octane-d6

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

Density: 0.7±0.1 g/cm3
Boiling Point: 126.4±3.0 °C at 760 mmHg
Vapour Pressure: 14.2±0.1 mmHg at 25°C
Enthalpy of Vaporization: 34.4±0.0 kJ/mol
Flash Point: 15.6±0.0 °C
Index of Refraction: 1.402
Molar Refractivity: 39.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 5.02
ACD/BCF (pH 5.5): 3824.96
ACD/KOC (pH 5.5): 12765.49
ACD/LogD (pH 7.4): 5.02
ACD/BCF (pH 7.4): 3824.96
ACD/KOC (pH 7.4): 12765.49
Polar Surface Area: 0 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 22.7±3.0 dyne/cm
Molar Volume: 160.6±3.0 cm3

Click to predict properties on the Chemicalize site


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