ChemSpider 2D Image | (3S,6S)-3,6-Dimethylcyclohexene | C8H14

(3S,6S)-3,6-Dimethylcyclohexene

  • Molecular FormulaC8H14
  • Average mass110.197 Da
  • Monoisotopic mass110.109550 Da
  • ChemSpider ID73977423

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,6S)-3,6-Dimethylcyclohexen [German] [ACD/IUPAC Name]
(3S,6S)-3,6-Dimethylcyclohexene [ACD/IUPAC Name]
(3S,6S)-3,6-Diméthylcyclohexène [French] [ACD/IUPAC Name]
Cyclohexene, 3,6-dimethyl-, (3S,6S)- [ACD/Index Name]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 122.5±7.0 °C at 760 mmHg
Vapour Pressure: 16.7±0.1 mmHg at 25°C
Enthalpy of Vaporization: 34.6±0.8 kJ/mol
Flash Point: 6.8±10.3 °C
Index of Refraction: 1.438
Molar Refractivity: 36.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 3.72
ACD/BCF (pH 5.5): 398.46
ACD/KOC (pH 5.5): 2529.05
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 398.46
ACD/KOC (pH 7.4): 2529.05
Polar Surface Area: 0 Å2
Polarizability: 14.5±0.5 10-24cm3
Surface Tension: 24.3±3.0 dyne/cm
Molar Volume: 139.7±3.0 cm3

Click to predict properties on the Chemicalize site


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