ChemSpider 2D Image | (13E)-9,11,15-Tris(isobutyryloxy)prost-13-en-1-oic acid | C32H54O8

(13E)-9,11,15-Tris(isobutyryloxy)prost-13-en-1-oic acid

  • Molecular FormulaC32H54O8
  • Average mass566.766 Da
  • Monoisotopic mass566.381897 Da
  • ChemSpider ID8048402
  • Double-bond stereo - Double-bond stereo


More details:






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

(13E)-9,11,15-Tris(isobutyryloxy)prost-13-en-1-oic acid [ACD/IUPAC Name]
(13E)-9,11,15-Tris(isobutyryloxy)prost-13-en-1-säure [German] [ACD/IUPAC Name]
Acide (13E)-9,11,15-tris(isobutyryloxy)prost-13-én-1-oïque [French] [ACD/IUPAC Name]
Prost-13-en-1-oic acid, 9,11,15-tris(2-methyl-1-oxopropoxy)-, (13E)- [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: 625.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 101.1±6.0 kJ/mol
Flash Point: 184.4±25.0 °C
Index of Refraction: 1.494
Molar Refractivity: 155.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 2
ACD/LogP: 8.36
ACD/LogD (pH 5.5): 7.03
ACD/BCF (pH 5.5): 83576.07
ACD/KOC (pH 5.5): 68912.93
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 1340.50
ACD/KOC (pH 7.4): 1105.32
Polar Surface Area: 116 Å2
Polarizability: 61.5±0.5 10-24cm3
Surface Tension: 41.4±5.0 dyne/cm
Molar Volume: 533.3±5.0 cm3

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