Found 157 results

Search term: MF = 'C_{32}H_{41}NO_{4}'
ChemSpider 2D Image | Ethyl 4-benzyl-1-(12-hydroxy-16-oxopodocarpa-8,11,13-trien-16-yl)-4-piperidinecarboxylate | C32H41NO4

Ethyl 4-benzyl-1-(12-hydroxy-16-oxopodocarpa-8,11,13-trien-16-yl)-4-piperidinecarboxylate

  • Molecular FormulaC32H41NO4
  • Average mass503.672 Da
  • Monoisotopic mass503.303558 Da
  • ChemSpider ID8431024

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

4-Benzyl-1-(12-hydroxy-16-oxopodocarpa-8,11,13-trién-16-yl)-4-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[[(1S,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-dimethyl-1-phenanthrenyl]carbonyl]-4-(phenylmethyl)-, ethyl ester [ACD/Index Name]
Ethyl 4-benzyl-1-(12-hydroxy-16-oxopodocarpa-8,11,13-trien-16-yl)-4-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-benzyl-1-(12-hydroxy-16-oxopodocarpa-8,11,13-trien-16-yl)-4-piperidincarboxylat [German] [ACD/IUPAC 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: 647.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.9±3.0 kJ/mol
Flash Point: 345.1±31.5 °C
Index of Refraction: 1.578
Molar Refractivity: 144.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 7.46
ACD/LogD (pH 5.5): 7.07
ACD/BCF (pH 5.5): 139951.94
ACD/KOC (pH 5.5): 167906.36
ACD/LogD (pH 7.4): 7.07
ACD/BCF (pH 7.4): 139775.50
ACD/KOC (pH 7.4): 167694.67
Polar Surface Area: 67 Å2
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 435.5±3.0 cm3

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