ChemSpider 2D Image | (7E,12alpha)-12-Methoxy-1,6:15,20-dicycloprosta-1,3,5,7,13,15,17,19-octaen-11-one | C21H20O2

(7E,12α)-12-Methoxy-1,6:15,20-dicycloprosta-1,3,5,7,13,15,17,19-octaen-11-one

  • Molecular FormulaC21H20O2
  • Average mass304.382 Da
  • Monoisotopic mass304.146332 Da
  • ChemSpider ID21199730

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(7E,12α)-12-Methoxy-1,6:15,20-dicycloprosta-1,3,5,7,13,15,17,19-octaen-11-on [German] [ACD/IUPAC Name]
(7E,12α)-12-Methoxy-1,6:15,20-dicycloprosta-1,3,5,7,13,15,17,19-octaen-11-one [ACD/IUPAC Name]
(7E,12α)-12-Méthoxy-1,6:15,20-dicycloprosta-1,3,5,7,13,15,17,19-octaén-11-one [French] [ACD/IUPAC Name]
Cyclopentanone, 2-methoxy-2-(2-phenylethenyl)-3-(phenylmethylene)-, (2R,3E)- [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: 470.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.3±3.0 kJ/mol
Flash Point: 203.1±22.3 °C
Index of Refraction: 1.605
Molar Refractivity: 92.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.05
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 531.20
ACD/KOC (pH 5.5): 3107.01
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 531.20
ACD/KOC (pH 7.4): 3107.01
Polar Surface Area: 26 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 46.6±5.0 dyne/cm
Molar Volume: 268.6±5.0 cm3

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