ChemSpider 2D Image | (20xi)-20-Hydroxy-3,12,15,23-tetraoxolanosta-7,9(11),16-trien-26-oic acid | C30H38O7

(20ξ)-20-Hydroxy-3,12,15,23-tetraoxolanosta-7,9(11),16-trien-26-oic acid

  • Molecular FormulaC30H38O7
  • Average mass510.618 Da
  • Monoisotopic mass510.261749 Da
  • ChemSpider ID78439559

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

(20ξ)-20-Hydroxy-3,12,15,23-tetraoxolanosta-7,9(11),16-trien-26-oic acid [ACD/IUPAC Name]
(20ξ)-20-Hydroxy-3,12,15,23-tetraoxolanosta-7,9(11),16-trien-26-säure [German] [ACD/IUPAC Name]
Acide (20ξ)-20-hydroxy-3,12,15,23-tétraoxolanosta-7,9(11),16-trién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-7,9(11),16-trien-26-oic acid, 20-hydroxy-3,12,15,23-tetraoxo-, (20ξ)- [ACD/Index Name]
20-hydroxy-3,12,15,23-tetraoxolanosta-7,9(11),16-trien-26-oic 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: 733.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 122.2±6.0 kJ/mol
Flash Point: 411.4±29.4 °C
Index of Refraction: 1.583
Molar Refractivity: 135.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 13.76
ACD/KOC (pH 5.5): 137.44
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.22
Polar Surface Area: 126 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 54.7±5.0 dyne/cm
Molar Volume: 405.6±5.0 cm3

Click to predict properties on the Chemicalize site


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