ChemSpider 2D Image | (5Z,11alpha)-11-Hydroxy-9,15-dioxoprost-5-en-1-oate | C20H31O5

(5Z,11α)-11-Hydroxy-9,15-dioxoprost-5-en-1-oate

  • Molecular FormulaC20H31O5
  • Average mass351.458 Da
  • Monoisotopic mass351.217712 Da
  • ChemSpider ID26330773
  • Charge - Charge

    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,11α)-11-Hydroxy-9,15-dioxoprost-5-en-1-oat [German] [ACD/IUPAC Name]
(5Z,11α)-11-Hydroxy-9,15-dioxoprost-5-en-1-oate [ACD/IUPAC Name]
(5Z,11α)-11-Hydroxy-9,15-dioxoprost-5-én-1-oate [French] [ACD/IUPAC Name]
Prost-5-en-1-oic acid, 11-hydroxy-9,15-dioxo-, ion(1-), (5Z,11α)- [ACD/Index Name]
(5Z)-11α-hydroxy-9,15-dioxoprost-5-enoate
13,14-dihydro-15-oxo-prostaglandin E2
13,14-dihydro-15-oxo-prostaglandin E2(1-)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 538.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.7±6.0 kJ/mol
Flash Point: 293.3±25.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 4.71
ACD/KOC (pH 5.5): 61.78
ACD/LogD (pH 7.4): -0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability:
Surface Tension:
Molar Volume:

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