ChemSpider 2D Image | (5Z,11alpha)-11-Hydroxy-9,15-dioxo(3,3,4,4-~2~H_4_)prost-5-en-1-oic acid | C20H28D4O5

(5Z,11α)-11-Hydroxy-9,15-dioxo(3,3,4,4-2H4)prost-5-en-1-oic acid

  • Molecular FormulaC20H28D4O5
  • Average mass356.490 Da
  • Monoisotopic mass356.250092 Da
  • ChemSpider ID21467802

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(5Z,11α)-11-Hydroxy-9,15-dioxo(3,3,4,4-2H4)prost-5-en-1-oic acid [ACD/IUPAC Name]
(5Z,11α)-11-Hydroxy-9,15-dioxo(3,3,4,4-2H4)prost-5-en-1-säure [German] [ACD/IUPAC Name]
Acide (5Z,11α)-11-hydroxy-9,15-dioxo(3,3,4,4-2H4)prost-5-én-1-oïque [French] [ACD/IUPAC Name]
Prost-5-en-1-oic-3,3,4,4-d4 acid, 11-hydroxy-9,15-dioxo-, (5Z,11α)- [ACD/Index Name]
13,14-dihydro-15-keto Prostaglandin E2-d4
9,15-dioxo-11?-hydroxy-prost-5Z-en-1-oic-3,3,4,4-d4 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: 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: 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: 1.88
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: 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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