ChemSpider 2D Image | 1-Propanamine, 3-[(3b)-cholest-5-en-3-yloxy]- | C30H53NO

1-Propanamine, 3-[(3b)-cholest-5-en-3-yloxy]-

  • Molecular FormulaC30H53NO
  • Average mass443.748 Da
  • Monoisotopic mass443.412720 Da
  • ChemSpider ID32815864

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

1-Propanamine, 3-[(3b)-cholest-5-en-3-yloxy]-
1-Propanamine, 3-[(3β)-cholest-5-en-3-yloxy]- [ACD/Index Name]
3-[(3β)-Cholest-5-en-3-yloxy]-1-propanamin [German] [ACD/IUPAC Name]
3-[(3β)-Cholest-5-en-3-yloxy]-1-propanamine [ACD/IUPAC Name]
3-[(3β)-Cholest-5-én-3-yloxy]-1-propanamine [French] [ACD/IUPAC Name]
71507-49-8 [RN]
3-[(3β-CHOLEST-5-EN-3-YL)OXY]-1-PROPANAMINE
3-{[(3β)-Cholest-5-en-3-yl]oxy}propan-1-amine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 535.1±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 247.2±18.6 °C
Index of Refraction: 1.521
Molar Refractivity: 137.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 10.15
ACD/LogD (pH 5.5): 5.32
ACD/BCF (pH 5.5): 1192.61
ACD/KOC (pH 5.5): 744.33
ACD/LogD (pH 7.4): 6.13
ACD/BCF (pH 7.4): 7783.01
ACD/KOC (pH 7.4): 4857.54
Polar Surface Area: 35 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 38.5±5.0 dyne/cm
Molar Volume: 452.0±5.0 cm3

Click to predict properties on the Chemicalize site


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