ChemSpider 2D Image | (5E,9alpha)-9-Hydroxy-11,15-dioxoprost-5-en-1-oic acid | C20H32O5

(5E,9α)-9-Hydroxy-11,15-dioxoprost-5-en-1-oic acid

  • Molecular FormulaC20H32O5
  • Average mass352.465 Da
  • Monoisotopic mass352.224976 Da
  • ChemSpider ID31044463

  • 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

(5E,9α)-9-Hydroxy-11,15-dioxoprost-5-en-1-oic acid [ACD/IUPAC Name]
(5E,9α)-9-Hydroxy-11,15-dioxoprost-5-en-1-säure [German] [ACD/IUPAC Name]
Acide (5E,9α)-9-hydroxy-11,15-dioxoprost-5-én-1-oïque [French] [ACD/IUPAC Name]
Prost-5-en-1-oic acid, 9-hydroxy-11,15-dioxo-, (5E,9α)- [ACD/Index Name]
13,14-DIHYDRO-15-KETO PROSTAGLANDIN D2
59894-07-4 [RN]
7-[(1R,2R,5S)-5-Hydroxy-3-oxo-2-(3-oxooctyl)cyclopentyl]hept-5-enoic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 542.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.3±6.0 kJ/mol
Flash Point: 295.7±23.8 °C
Index of Refraction: 1.504
Molar Refractivity: 96.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 4.65
ACD/KOC (pH 5.5): 61.29
ACD/LogD (pH 7.4): -0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 324.3±3.0 cm3

Click to predict properties on the Chemicalize site


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