ChemSpider 2D Image | (2R,3R,4R,5S)-1-Benzyl-3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]piperidine | C41H43NO4

(2R,3R,4R,5S)-1-Benzyl-3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]piperidine

  • Molecular FormulaC41H43NO4
  • Average mass613.784 Da
  • Monoisotopic mass613.319214 Da
  • ChemSpider ID82963223

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3R,4R,5S)-1-Benzyl-3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]piperidin [German] [ACD/IUPAC Name]
(2R,3R,4R,5S)-1-Benzyl-3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]piperidine [ACD/IUPAC Name]
(2R,3R,4R,5S)-1-Benzyl-3,4,5-tris(benzyloxy)-2-[(benzyloxy)méthyl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 3,4,5-tris(phenylmethoxy)-2-[(phenylmethoxy)methyl]-1-(phenylmethyl)-, (2R,3R,4R,5S)- [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: 695.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 167.5±28.7 °C
Index of Refraction: 1.633
Molar Refractivity: 185.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 10.08
ACD/LogD (pH 5.5): 6.67
ACD/BCF (pH 5.5): 21865.74
ACD/KOC (pH 5.5): 11437.50
ACD/LogD (pH 7.4): 8.32
ACD/BCF (pH 7.4): 986088.81
ACD/KOC (pH 7.4): 515801.88
Polar Surface Area: 40 Å2
Polarizability: 73.4±0.5 10-24cm3
Surface Tension: 54.4±5.0 dyne/cm
Molar Volume: 519.0±5.0 cm3

Click to predict properties on the Chemicalize site


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