ChemSpider 2D Image | MFCD00190301 | C2313CH40O4

MFCD00190301

  • Molecular FormulaC2313CH40O4
  • Average mass393.565 Da
  • Monoisotopic mass393.296021 Da
  • ChemSpider ID32814844

  • defined stereocentres - 10 of 10 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3α,5β,12α)-3,12-Dihydroxy(24-13C)cholan-24-oic acid [ACD/IUPAC Name]
(3α,5β,12α)-3,12-Dihydroxy(24-13C)cholan-24-säure [German] [ACD/IUPAC Name]
(3α,5β,12β)-3,12-Dihydroxy(24-13C)cholan-24-oic acid [ACD/IUPAC Name]
(3α,5β,12β)-3,12-Dihydroxy(24-13C)cholan-24-säure [German] [ACD/IUPAC Name]
3a,12a-Dihydroxy-5??-cholanic acid-24-13C
52886-37-0 [RN]
7-Deoxycholic acid-24-13C
Acide (3α,5β,12α)-3,12-dihydroxy(24-13C)cholan-24-oïque [French] [ACD/IUPAC Name]
Acide (3α,5β,12β)-3,12-dihydroxy(24-13C)cholan-24-oïque [French] [ACD/IUPAC Name]
Cholan-24-oic-24-13C acid, 3,12-dihydroxy-, (3α,5β,12α)- [ACD/Index Name]
More...

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.543
Molar Refractivity: 109.7±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 347.9±3.0 cm3

Click to predict properties on the Chemicalize site


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