ChemSpider 2D Image | (1S,2E,5S)-1-Cyclohexyl-7-phenyl-2-heptene-1,5-diol | C19H28O2

(1S,2E,5S)-1-Cyclohexyl-7-phenyl-2-heptene-1,5-diol

  • Molecular FormulaC19H28O2
  • Average mass288.424 Da
  • Monoisotopic mass288.208923 Da
  • ChemSpider ID30659252

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2E,5S)-1-Cyclohexyl-7-phenyl-2-hepten-1,5-diol [German] [ACD/IUPAC Name]
(1S,2E,5S)-1-Cyclohexyl-7-phenyl-2-heptene-1,5-diol [ACD/IUPAC Name]
(1S,2E,5S)-1-Cyclohexyl-7-phényl-2-heptène-1,5-diol [French] [ACD/IUPAC Name]
2-Heptene-1,5-diol, 1-cyclohexyl-7-phenyl-, (1S,2E,5S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 466.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 213.3±23.3 °C
Index of Refraction: 1.552
Molar Refractivity: 87.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 585.60
ACD/KOC (pH 5.5): 3331.61
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 585.60
ACD/KOC (pH 7.4): 3331.61
Polar Surface Area: 40 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 274.3±3.0 cm3

Click to predict properties on the Chemicalize site


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