ChemSpider 2D Image | Methyl (3beta,5beta,12alpha)-3-(azidomethyl)-3,12-dihydroxycholan-24-oate | C26H43N3O4

Methyl (3β,5β,12α)-3-(azidomethyl)-3,12-dihydroxycholan-24-oate

  • Molecular FormulaC26H43N3O4
  • Average mass461.637 Da
  • Monoisotopic mass461.325348 Da
  • ChemSpider ID24653513

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(3β,5β,12α)-3-(Azidométhyl)-3,12-dihydroxycholan-24-oate de méthyle [French] [ACD/IUPAC Name]
Cholan-24-oic acid, 3-(azidomethyl)-3,12-dihydroxy-, methyl ester, (3β,5β,12α)- [ACD/Index Name]
Methyl (3β,5β,12α)-3-(azidomethyl)-3,12-dihydroxycholan-24-oate [ACD/IUPAC Name]
Methyl-(3β,5β,12α)-3-(azidomethyl)-3,12-dihydroxycholan-24-oat [German] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.05
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 2826.49
ACD/KOC (pH 5.5): 10280.13
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2826.49
ACD/KOC (pH 7.4): 10280.13
Polar Surface Area: 79 Å2
Polarizability:
Surface Tension:
Molar Volume:

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