ChemSpider 2D Image | 3-Hydroxylup-20(29)-ene-23,27,28-trioic acid | C30H44O7

3-Hydroxylup-20(29)-ene-23,27,28-trioic acid

  • Molecular FormulaC30H44O7
  • Average mass516.666 Da
  • Monoisotopic mass516.308716 Da
  • ChemSpider ID22370343

More details:

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

3-Hydroxylup-20(29)-en-23,27,28-trisäure [German] [ACD/IUPAC Name]
3-Hydroxylup-20(29)-ene-23,27,28-trioic acid [ACD/IUPAC Name]
Acide 3-hydroxylup-20(29)-ène-23,27,28-trioïque [French] [ACD/IUPAC Name]
Lup-20(29)-ene-23,27,28-trioic acid, 3-hydroxy- [ACD/Index Name]
9-Hydroxy-5b,8,11a-trimethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,5a,8-tricarboxylic acid
Compound NP-012598

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

Density: 1.3±0.1 g/cm3
Boiling Point: 684.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.8±6.0 kJ/mol
Flash Point: 381.7±28.0 °C
Index of Refraction: 1.572
Molar Refractivity: 136.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 5.59
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 2.44
ACD/KOC (pH 5.5): 7.33
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 413.3±3.0 cm3

Click to predict properties on the Chemicalize site


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