ChemSpider 2D Image | (1S,5R)-5-tert-butyl-1-deuterio-cyclohex-2-en-1-ol | C10H17DO

(1S,5R)-5-tert-butyl-1-deuterio-cyclohex-2-en-1-ol

  • Molecular FormulaC10H17DO
  • Average mass155.255 Da
  • Monoisotopic mass155.142044 Da
  • ChemSpider ID8900924

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(1S,5R)-5-(2-Methyl-2-propanyl)(1-2H)-2-cyclohexen-1-ol [German] [ACD/IUPAC Name]
(1S,5R)-5-(2-Méthyl-2-propanyl)(1-2H)-2-cyclohexén-1-ol [French] [ACD/IUPAC 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: 218.8±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 52.9±6.0 kJ/mol
Flash Point: 88.7±13.7 °C
Index of Refraction: 1.489
Molar Refractivity: 47.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.70
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.15
ACD/KOC (pH 5.5): 497.92
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.15
ACD/KOC (pH 7.4): 497.92
Polar Surface Area: 20 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 163.0±3.0 cm3

Click to predict properties on the Chemicalize site


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