ChemSpider 2D Image | 7-[(6-O-Acetylhexopyranosyl)oxy]-23-hydroxy-4,4,8-trimethyl-22-methylene-13,24-cyclo-18-norchol-14-en-3-yl acetate | C37H56O10

7-[(6-O-Acetylhexopyranosyl)oxy]-23-hydroxy-4,4,8-trimethyl-22-methylene-13,24-cyclo-18-norchol-14-en-3-yl acetate

  • Molecular FormulaC37H56O10
  • Average mass660.834 Da
  • Monoisotopic mass660.387329 Da
  • ChemSpider ID2967715

More details:

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

7-[(6-O-Acetylhexopyranosyl)oxy]-23-hydroxy-4,4,8-trimethyl-22-methylen-13,24-cyclo-18-norchol-14-en-3-yl-acetat [German] [ACD/IUPAC Name]
7-[(6-O-Acetylhexopyranosyl)oxy]-23-hydroxy-4,4,8-trimethyl-22-methylene-13,24-cyclo-18-norchol-14-en-3-yl acetate [ACD/IUPAC Name]
Acétate de 7-[(6-O-acétylhexopyranosyl)oxy]-23-hydroxy-4,4,8-triméthyl-22-méthylène-13,24-cyclo-18-norchol-14-én-3-yle [French] [ACD/IUPAC Name]
Hexopyranoside, 10-(acetyloxy)-1,2,3,4,4a,5,6b,7,8,8a,9,10,11,12,12a,12b,13,14-octadecahydro-2-hydroxy-4,6b,9,9,12a-pentamethyl-3-methyleneindeno[1,7a-a]phenanthren-7-yl, 6-acetate [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: 738.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.9±6.0 kJ/mol
Flash Point: 221.4±26.4 °C
Index of Refraction: 1.578
Molar Refractivity: 173.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 6.91
ACD/LogD (pH 5.5): 5.94
ACD/BCF (pH 5.5): 19220.53
ACD/KOC (pH 5.5): 40542.02
ACD/LogD (pH 7.4): 5.94
ACD/BCF (pH 7.4): 19220.36
ACD/KOC (pH 7.4): 40541.66
Polar Surface Area: 152 Å2
Polarizability: 68.8±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 522.6±5.0 cm3

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