ChemSpider 2D Image | (1'r,4's)-4'-Propyl-1,1'-bi(cyclohexyl)-4-one | C15H26O

(1'r,4's)-4'-Propyl-1,1'-bi(cyclohexyl)-4-one

  • Molecular FormulaC15H26O
  • Average mass222.366 Da
  • Monoisotopic mass222.198364 Da
  • ChemSpider ID113607528

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1'r,4's)-4'-Propyl-1,1'-bi(cyclohexyl)-4-on [German] [ACD/IUPAC Name]
(1'r,4's)-4'-Propyl-1,1'-bi(cyclohexyl)-4-one [ACD/IUPAC Name]
(1'r,4's)-4'-Propyl-1,1'-bi(cyclohexyl)-4-one [French] [ACD/IUPAC Name]
[1,1'-Bicyclohexyl]-4-one, 4'-propyl- [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: 313.7±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 135.9±11.3 °C
Index of Refraction: 1.481
Molar Refractivity: 67.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.87
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1404.35
ACD/KOC (pH 5.5): 6231.07
ACD/LogD (pH 7.4): 4.44
ACD/BCF (pH 7.4): 1404.35
ACD/KOC (pH 7.4): 6231.07
Polar Surface Area: 17 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 33.6±3.0 dyne/cm
Molar Volume: 237.1±3.0 cm3

Click to predict properties on the Chemicalize site


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