ChemSpider 2D Image | (5Z,9alpha,12E,15R)-9,15-Dihydroxy-11-oxoprosta-5,12-dien-1-oic acid | C20H32O5

(5Z,9α,12E,15R)-9,15-Dihydroxy-11-oxoprosta-5,12-dien-1-oic acid

  • Molecular FormulaC20H32O5
  • Average mass352.465 Da
  • Monoisotopic mass352.224976 Da
  • ChemSpider ID76801886

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5Z,9α,12E,15R)-9,15-Dihydroxy-11-oxoprosta-5,12-dien-1-oic acid [ACD/IUPAC Name]
(5Z,9α,12E,15R)-9,15-Dihydroxy-11-oxoprosta-5,12-dien-1-säure [German] [ACD/IUPAC Name]
Acide (5Z,9α,12E,15R)-9,15-dihydroxy-11-oxoprosta-5,12-dién-1-oïque [French] [ACD/IUPAC Name]
Prosta-5,12-dien-1-oic acid, 9,15-dihydroxy-11-oxo-, (5Z,9α,12E,15R)- [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: 570.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.2±6.0 kJ/mol
Flash Point: 312.6±26.6 °C
Index of Refraction: 1.564
Molar Refractivity: 99.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 12.75
ACD/KOC (pH 5.5): 125.93
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.01
Polar Surface Area: 95 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 304.7±3.0 cm3

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