ChemSpider 2D Image | (8beta,11beta,13E,15R)-11,15-Dihydroxy(3,3,4,4-~2~H_4_)prost-13-en-9-one | C20H32D4O3

(8β,11β,13E,15R)-11,15-Dihydroxy(3,3,4,4-2H4)prost-13-en-9-one

  • Molecular FormulaC20H32D4O3
  • Average mass328.523 Da
  • Monoisotopic mass328.291565 Da
  • ChemSpider ID21467454

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(8β,11β,13E,15R)-11,15-Dihydroxy(3,3,4,4-2H4)prost-13-en-9-on [German] [ACD/IUPAC Name]
(8β,11β,13E,15R)-11,15-Dihydroxy(3,3,4,4-2H4)prost-13-en-9-one [ACD/IUPAC Name]
(8β,11β,13E,15R)-11,15-Dihydroxy(3,3,4,4-2H4)prost-13-én-9-one [French] [ACD/IUPAC Name]
Prost-13-en-9-one-3,3,4,4-d4, 11,15-dihydroxy-, (8β,11β,13E,15R)- [ACD/Index Name]
Prostaglandin E1-d4

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

Density: 1.0±0.1 g/cm3
Boiling Point: 447.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.4±6.0 kJ/mol
Flash Point: 238.6±25.2 °C
Index of Refraction: 1.525
Molar Refractivity: 97.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 4.58
ACD/BCF (pH 5.5): 1772.56
ACD/KOC (pH 5.5): 7361.17
ACD/LogD (pH 7.4): 4.58
ACD/BCF (pH 7.4): 1772.56
ACD/KOC (pH 7.4): 7361.16
Polar Surface Area: 58 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 318.6±3.0 cm3

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