ChemSpider 2D Image | 2,3,16,23,24-Pentahydroxyolean-12-en-28-oic acid | C30H48O7

2,3,16,23,24-Pentahydroxyolean-12-en-28-oic acid

  • Molecular FormulaC30H48O7
  • Average mass520.698 Da
  • Monoisotopic mass520.340027 Da
  • ChemSpider ID282180

More details:

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

2,3,16,23,24-Pentahydroxyolean-12-en-28-oic acid [ACD/IUPAC Name]
2,3,16,23,24-Pentahydroxyolean-12-en-28-säure [German] [ACD/IUPAC Name]
Acide 2,3,16,23,24-pentahydroxyoléan-12-én-28-oïque [French] [ACD/IUPAC Name]
Olean-12-en-28-oic acid, 2,3,16,23,24-pentahydroxy- [ACD/Index Name]
22327-82-8 [RN]
5,10,11-trihydroxy-9,9-bis(hydroxymethyl)-2,2,6a,6b,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

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

NSC258313 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 675.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.5±6.0 kJ/mol
Flash Point: 376.3±28.0 °C
Index of Refraction: 1.606
Molar Refractivity: 139.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 43.79
ACD/KOC (pH 5.5): 243.03
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.90
Polar Surface Area: 138 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 63.0±5.0 dyne/cm
Molar Volume: 405.1±5.0 cm3

Click to predict properties on the Chemicalize site


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