ChemSpider 2D Image | Prostaglandin D2 Ethanolamide | C22H37NO5

Prostaglandin D2 Ethanolamide

  • Molecular FormulaC22H37NO5
  • Average mass395.533 Da
  • Monoisotopic mass395.267181 Da
  • ChemSpider ID21466969

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 4 defined stereocentres

More details:

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

(5Z,8ξ,13E)-9,15-Dihydroxy-N-(2-hydroxyethyl)-11-oxoprosta-5,13-dien-1-amid [German] [ACD/IUPAC Name]
(5Z,8ξ,13E)-9,15-Dihydroxy-N-(2-hydroxyethyl)-11-oxoprosta-5,13-dien-1-amide [ACD/IUPAC Name]
(5Z,8ξ,13E)-9,15-Dihydroxy-N-(2-hydroxyéthyl)-11-oxoprosta-5,13-dién-1-amide [French] [ACD/IUPAC Name]
398138-28-8 [RN]
Prosta-5,13-dien-1-amide, 9,15-dihydroxy-N-(2-hydroxyethyl)-11-oxo-, (5Z,8ξ,13E)- [ACD/Index Name]
Prostaglandin D2 Ethanolamide
N-(2-hydroxyethyl)-11-oxo-9?,15S-dihydroxy-prosta-5Z,13E-dien-1-amide
N-(2-hydroxyethyl)-11-oxo-9α,15S-dihydroxy-prosta-5Z,13E-dien-1-amide
N-(2-HYDROXYETHYL)-11-OXO-9α,15S-DIHYDROXY-PROSTA-5Z,13E-DIEN-1-AMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 630.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 106.9±6.0 kJ/mol
Flash Point: 335.2±31.5 °C
Index of Refraction: 1.556
Molar Refractivity: 112.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 0.77
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.68
ACD/KOC (pH 5.5): 202.15
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.68
ACD/KOC (pH 7.4): 202.15
Polar Surface Area: 107 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 348.7±3.0 cm3

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