ChemSpider 2D Image | 5,6-DIHYDRO PGE3 | C20H32O5

5,6-DIHYDRO PGE3

  • Molecular FormulaC20H32O5
  • Average mass352.465 Da
  • Monoisotopic mass352.224976 Da
  • ChemSpider ID28537063

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(11α,13E,15S,17E)-11,15-Dihydroxy-9-oxoprosta-13,17-dien-1-oic acid [ACD/IUPAC Name]
(11α,13E,15S,17E)-11,15-Dihydroxy-9-oxoprosta-13,17-dien-1-säure [German] [ACD/IUPAC Name]
119008-22-9 [RN]
5,6-DIHYDRO PGE3
Acide (11α,13E,15S,17E)-11,15-dihydroxy-9-oxoprosta-13,17-dién-1-oïque [French] [ACD/IUPAC Name]
Prosta-13,17-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, (11α,13E,15S,17E)- [ACD/Index Name]
[119008-22-9] [RN]
7-((1R,2R,3R)-3-Hydroxy-2-((S,1E,5E)-3-hydroxyocta-1,5-dien-1-yl)-5-oxocyclopentyl)heptanoic acid
7-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S,5E)-3-hydroxyocta-1,5-dienyl]-5-oxocyclopentyl]heptanoic acid
MFCD00216051 [MDL number]
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 539.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.3 mmHg at 25°C
    Enthalpy of Vaporization: 94.0±6.0 kJ/mol
    Flash Point: 294.4±26.6 °C
    Index of Refraction: 1.561
    Molar Refractivity: 99.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 0
    ACD/LogP: 1.79
    ACD/LogD (pH 5.5): 1.25
    ACD/BCF (pH 5.5): 3.34
    ACD/KOC (pH 5.5): 48.87
    ACD/LogD (pH 7.4): -0.55
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 95 Å2
    Polarizability: 39.4±0.5 10-24cm3
    Surface Tension: 53.6±3.0 dyne/cm
    Molar Volume: 306.8±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement