ChemSpider 2D Image | tetranor-PGEM | C16H24O7

tetranor-PGEM

  • Molecular FormulaC16H24O7
  • Average mass328.358 Da
  • Monoisotopic mass328.152191 Da
  • ChemSpider ID21467044

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

8-[(1R)-2-(2-Carboxyethyl)-5-hydroxy-3-oxocyclopentyl]-6-oxooctanoic acid [ACD/IUPAC Name]
8-[(1R)-2-(2-Carboxyethyl)-5-hydroxy-3-oxocyclopentyl]-6-oxooctansäure [German] [ACD/IUPAC Name]
Acide 8-[(1R)-2-(2-carboxyéthyl)-5-hydroxy-3-oxocyclopentyl]-6-oxooctanoïque [French] [ACD/IUPAC Name]
Cyclopentaneoctanoic acid, 2-(2-carboxyethyl)-5-hydroxy-ε,3-dioxo-, (1R)- [ACD/Index Name]
tetranor-PGEM
tetranor-Prostaglandin E Metabolite
24769-56-0 [RN]
9,15-dioxo-11?-hydroxy-13,14-dihydro-2,3,4,5-tetranor-prostan-1,20-dioic acid
9,15-dioxo-11?-hydroxy-2,3,4,5-tetranor-prostan-1,20-dioic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 622.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.7±6.0 kJ/mol
Flash Point: 344.1±26.6 °C
Index of Refraction: 1.522
Molar Refractivity: 79.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: -1.38
ACD/LogD (pH 5.5): -2.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 259.3±3.0 cm3

Click to predict properties on the Chemicalize site


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