ChemSpider 2D Image | 10-Formyl-9-hydroxy-1-isopropenyl-5a,5b,8,8,10a-pentamethyloctadecahydrodicyclopenta[a,i]phenanthrene-3a(1H)-carboxylic acid | C30H46O4

10-Formyl-9-hydroxy-1-isopropenyl-5a,5b,8,8,10a-pentamethyloctadecahydrodicyclopenta[a,i]phenanthrene-3a(1H)-carboxylic acid

  • Molecular FormulaC30H46O4
  • Average mass470.684 Da
  • Monoisotopic mass470.339600 Da
  • ChemSpider ID22370281

More details:

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

10-Formyl-9-hydroxy-1-isopropenyl-5a,5b,8,8,10a-pentamethyloctadecahydrodicyclopenta[a,i]phenanthren-3a(1H)-carbonsäure [German] [ACD/IUPAC Name]
10-Formyl-9-hydroxy-1-isopropenyl-5a,5b,8,8,10a-pentamethyloctadecahydrodicyclopenta[a,i]phenanthrene-3a(1H)-carboxylic acid [ACD/IUPAC Name]
Acide 10-formyl-9-hydroxy-1-isopropényl-5a,5b,8,8,10a-pentaméthyloctadécahydrodicyclopenta[a,i]phénanthrène-3a(1H)-carboxylique [French] [ACD/IUPAC Name]
Dicyclopenta[a,i]phenanthrene-3a(1H)-carboxylic acid, 10-formyloctadecahydro-9-hydroxy-5a,5b,8,8,10a-pentamethyl-1-(1-methylethenyl)- [ACD/Index Name]
Colubrinic acid
Zizyberanalic acid

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 571.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.4±6.0 kJ/mol
Flash Point: 313.4±26.6 °C
Index of Refraction: 1.561
Molar Refractivity: 135.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 7.37
ACD/LogD (pH 5.5): 5.30
ACD/BCF (pH 5.5): 3689.98
ACD/KOC (pH 5.5): 6618.91
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 57.98
ACD/KOC (pH 7.4): 104.00
Polar Surface Area: 75 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 417.6±3.0 cm3

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