ChemSpider 2D Image | (16alpha,23E)-16,25-Dihydroxy-3-oxolanosta-7,9(11),23-trien-21-oic acid | C30H44O5

(16α,23E)-16,25-Dihydroxy-3-oxolanosta-7,9(11),23-trien-21-oic acid

  • Molecular FormulaC30H44O5
  • Average mass484.667 Da
  • Monoisotopic mass484.318878 Da
  • ChemSpider ID78442166

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(16α,23E)-16,25-Dihydroxy-3-oxolanosta-7,9(11),23-trien-21-oic acid [ACD/IUPAC Name]
(16α,23E)-16,25-Dihydroxy-3-oxolanosta-7,9(11),23-trien-21-säure [German] [ACD/IUPAC Name]
Acide (16α,23E)-16,25-dihydroxy-3-oxolanosta-7,9(11),23-trién-21-oïque [French] [ACD/IUPAC Name]
Lanosta-7,9(11),23-trien-21-oic acid, 16,25-dihydroxy-3-oxo-, (16α,23E)- [ACD/Index Name]
Piptolinic acid E

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

Density: 1.2±0.1 g/cm3
Boiling Point: 645.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.4 mmHg at 25°C
Enthalpy of Vaporization: 109.1±6.0 kJ/mol
Flash Point: 358.2±28.0 °C
Index of Refraction: 1.576
Molar Refractivity: 136.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.64
ACD/LogD (pH 5.5): 3.41
ACD/BCF (pH 5.5): 121.09
ACD/KOC (pH 5.5): 505.40
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 1.94
ACD/KOC (pH 7.4): 8.11
Polar Surface Area: 95 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 50.6±5.0 dyne/cm
Molar Volume: 413.8±5.0 cm3

Click to predict properties on the Chemicalize site


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