ChemSpider 2D Image | 16,23-Dihydroxy-3-(pentopyranosyloxy)olean-12-en-28-oic acid | C35H56O9

16,23-Dihydroxy-3-(pentopyranosyloxy)olean-12-en-28-oic acid

  • Molecular FormulaC35H56O9
  • Average mass620.814 Da
  • Monoisotopic mass620.392456 Da
  • ChemSpider ID24621141

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

16,23-Dihydroxy-3-(pentopyranosyloxy)olean-12-en-28-oic acid [ACD/IUPAC Name]
16,23-Dihydroxy-3-(pentopyranosyloxy)olean-12-en-28-säure [German] [ACD/IUPAC Name]
Acide 16,23-dihydroxy-3-(pentopyranosyloxy)oléan-12-én-28-oïque [French] [ACD/IUPAC Name]
Olean-12-en-28-oic acid, 16,23-dihydroxy-3-(pentopyranosyloxy)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 749.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 124.6±6.0 kJ/mol
Flash Point: 229.7±26.4 °C
Index of Refraction: 1.600
Molar Refractivity: 164.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 6.27
ACD/LogD (pH 5.5): 4.39
ACD/BCF (pH 5.5): 672.49
ACD/KOC (pH 5.5): 1731.74
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 10.77
ACD/KOC (pH 7.4): 27.73
Polar Surface Area: 157 Å2
Polarizability: 65.1±0.5 10-24cm3
Surface Tension: 61.8±5.0 dyne/cm
Molar Volume: 480.2±5.0 cm3

Click to predict properties on the Chemicalize site


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