ChemSpider 2D Image | (3beta,5alpha,6beta)-6-({3-[(4-Aminobutyl)amino]propyl}amino)cholest-7-ene-3,5-diol | C34H63N3O2

(3β,5α,6β)-6-({3-[(4-Aminobutyl)amino]propyl}amino)cholest-7-ene-3,5-diol

  • Molecular FormulaC34H63N3O2
  • Average mass545.883 Da
  • Monoisotopic mass545.492004 Da
  • ChemSpider ID24632279

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3β,5α,6β)-6-({3-[(4-Aminobutyl)amino]propyl}amino)cholest-7-en-3,5-diol [German] [ACD/IUPAC Name]
(3β,5α,6β)-6-({3-[(4-Aminobutyl)amino]propyl}amino)cholest-7-ene-3,5-diol [ACD/IUPAC Name]
(3β,5α,6β)-6-({3-[(4-Aminobutyl)amino]propyl}amino)cholest-7-ène-3,5-diol [French] [ACD/IUPAC Name]
Cholest-7-ene-3,5-diol, 6-[[3-[(4-aminobutyl)amino]propyl]amino]-, (3β,5α,6β)- [ACD/Index Name]
DENDROGENIN B

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

Density: 1.0±0.1 g/cm3
Boiling Point: 659.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 111.1±6.0 kJ/mol
Flash Point: 352.6±31.5 °C
Index of Refraction: 1.547
Molar Refractivity: 164.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 6
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 7.12
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.55
Polar Surface Area: 91 Å2
Polarizability: 65.4±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 520.1±5.0 cm3

Click to predict properties on the Chemicalize site


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