ChemSpider 2D Image | {2-[(3,7,12-Trihydroxy-24-oxocholan-24-yl)amino]ethyl}phosphonic acid | C26H46NO7P

{2-[(3,7,12-Trihydroxy-24-oxocholan-24-yl)amino]ethyl}phosphonic acid

  • Molecular FormulaC26H46NO7P
  • Average mass515.620 Da
  • Monoisotopic mass515.301208 Da
  • ChemSpider ID4294161

More details:

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

{2-[(3,7,12-Trihydroxy-24-oxocholan-24-yl)amino]ethyl}phosphonic acid [ACD/IUPAC Name]
{2-[(3,7,12-Trihydroxy-24-oxocholan-24-yl)amino]ethyl}phosphonsäure [German] [ACD/IUPAC Name]
Acide {2-[(3,7,12-trihydroxy-24-oxocholan-24-yl)amino]éthyl}phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [2-[(3,7,12-trihydroxy-24-oxocholan-24-yl)amino]ethyl]- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.562
Molar Refractivity: 132.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -2.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 157 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 408.3±3.0 cm3

Click to predict properties on the Chemicalize site


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