ChemSpider 2D Image | Strophanthidin, 3-((dibutylamino)acetyl)- | C33H51NO7

Strophanthidin, 3-((dibutylamino)acetyl)-

  • Molecular FormulaC33H51NO7
  • Average mass573.760 Da
  • Monoisotopic mass573.366577 Da
  • ChemSpider ID20087492

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β,5β)-3-[(β)-N,N-Dibutylglycyl]-3,5,14-trihydroxy-19-oxocard-20(22)-enolid [German] [ACD/IUPAC Name]
(3β,5β)-3-[(β)-N,N-Dibutylglycyl]-3,5,14-trihydroxy-19-oxocard-20(22)-enolide [ACD/IUPAC Name]
(3β,5β)-3-[(β)-N,N-Dibutylglycyl]-3,5,14-trihydroxy-19-oxocard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[2-(dibutylamino)acetyl]-3,5,14-trihydroxy-19-oxo-, (3β,5β)- [ACD/Index Name]
Strophanthidin, 3-((dibutylamino)acetyl)-
64011-27-4 [RN]
Strophanthidin, 3-di-n-butylaminoacetyl-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 723.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 120.7±6.0 kJ/mol
Flash Point: 391.6±32.9 °C
Index of Refraction: 1.607
Molar Refractivity: 156.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 1.44
ACD/KOC (pH 5.5): 14.87
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 43.90
ACD/KOC (pH 7.4): 453.04
Polar Surface Area: 124 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 64.8±3.0 dyne/cm
Molar Volume: 451.4±3.0 cm3

Click to predict properties on the Chemicalize site


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