ChemSpider 2D Image | 3-[(N,N-Diethylglycyl)oxy]-14-hydroxycard-20(22)-enolide | C29H45NO5

3-[(N,N-Diethylglycyl)oxy]-14-hydroxycard-20(22)-enolide

  • Molecular FormulaC29H45NO5
  • Average mass487.671 Da
  • Monoisotopic mass487.329773 Da
  • ChemSpider ID95638719

More details:

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

3-[(N,N-Diethylglycyl)oxy]-14-hydroxycard-20(22)-enolid [German] [ACD/IUPAC Name]
3-[(N,N-Diethylglycyl)oxy]-14-hydroxycard-20(22)-enolide [ACD/IUPAC Name]
3-[(N,N-Diéthylglycyl)oxy]-14-hydroxycard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[[2-(diethylamino)acetyl]oxy]-14-hydroxy- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 608.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.6±6.0 kJ/mol
Flash Point: 321.6±31.5 °C
Index of Refraction: 1.562
Molar Refractivity: 134.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 1.68
ACD/KOC (pH 5.5): 9.25
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 81.26
ACD/KOC (pH 7.4): 448.32
Polar Surface Area: 76 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 49.1±5.0 dyne/cm
Molar Volume: 415.9±5.0 cm3

Click to predict properties on the Chemicalize site


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