ChemSpider 2D Image | (5E,9alpha,11E,15S)-9,15-Dihydroxy-11-(methoxyimino)prosta-5,13-dien-1-oic acid | C21H35NO5

(5E,9α,11E,15S)-9,15-Dihydroxy-11-(methoxyimino)prosta-5,13-dien-1-oic acid

  • Molecular FormulaC21H35NO5
  • Average mass381.506 Da
  • Monoisotopic mass381.251526 Da
  • ChemSpider ID95636530

  • 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

(5E,9α,11E,15S)-9,15-Dihydroxy-11-(methoxyimino)prosta-5,13-dien-1-oic acid [ACD/IUPAC Name]
(5E,9α,11E,15S)-9,15-Dihydroxy-11-(methoxyimino)prosta-5,13-dien-1-säure [German] [ACD/IUPAC Name]
Acide (5E,9α,11E,15S)-9,15-dihydroxy-11-(méthoxyimino)prosta-5,13-dién-1-oïque [French] [ACD/IUPAC Name]
Prosta-5,13-dien-1-oic acid, 9,15-dihydroxy-11-(methoxyimino)-, (5E,9α,11E,15S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 556.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 96.3±6.0 kJ/mol
Flash Point: 290.2±32.9 °C
Index of Refraction: 1.524
Molar Refractivity: 104.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 25.11
ACD/KOC (pH 5.5): 204.91
ACD/LogD (pH 7.4): 0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.27
Polar Surface Area: 99 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 40.1±7.0 dyne/cm
Molar Volume: 340.6±7.0 cm3

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