Found 15 results

Search term: MF = 'C_{21}H_{23}O_{3}P'
ChemSpider 2D Image | (1R,3S,5Z)-5-[2-(Diphenylphosphoryl)ethylidene]-4-methylene-1,3-cyclohexanediol | C21H23O3P

(1R,3S,5Z)-5-[2-(Diphenylphosphoryl)ethylidene]-4-methylene-1,3-cyclohexanediol

  • Molecular FormulaC21H23O3P
  • Average mass354.379 Da
  • Monoisotopic mass354.138489 Da
  • ChemSpider ID78317135

  • 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

(1R,3S,5Z)-5-[2-(Diphenylphosphoryl)ethyliden]-4-methylen-1,3-cyclohexandiol [German] [ACD/IUPAC Name]
(1R,3S,5Z)-5-[2-(Diphenylphosphoryl)ethylidene]-4-methylene-1,3-cyclohexanediol [ACD/IUPAC Name]
(1R,3S,5Z)-5-[2-(Diphénylphosphoryl)éthylidène]-4-méthylène-1,3-cyclohexanediol [French] [ACD/IUPAC Name]
1,3-Cyclohexanediol, 5-[2-(diphenylphosphinyl)ethylidene]-4-methylene-, (1R,3S,5Z)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 530.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 274.3±30.1 °C
Index of Refraction: 1.610
Molar Refractivity: 100.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.62
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.37
ACD/KOC (pH 5.5): 517.06
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.37
ACD/KOC (pH 7.4): 517.06
Polar Surface Area: 67 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 288.5±5.0 cm3

Click to predict properties on the Chemicalize site


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