Found 22 results

Search term: MF = 'C_{39}H_{45}NO_{6}'
ChemSpider 2D Image | (5xi)-N-Acetyl-2,3,4,6-tetra-O-benzyl-1-propyl-D-xylo-hexopyranosylamine | C39H45NO6

(5ξ)-N-Acetyl-2,3,4,6-tetra-O-benzyl-1-propyl-D-xylo-hexopyranosylamine

  • Molecular FormulaC39H45NO6
  • Average mass623.778 Da
  • Monoisotopic mass623.324707 Da
  • ChemSpider ID26993690

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

(5ξ)-N-Acetyl-2,3,4,6-tetra-O-benzyl-1-propyl-D-xylo-hexopyranosylamin [German] [ACD/IUPAC Name]
(5ξ)-N-Acetyl-2,3,4,6-tetra-O-benzyl-1-propyl-D-xylo-hexopyranosylamine [ACD/IUPAC Name]
(5ξ)-N-Acétyl-2,3,4,6-tétra-O-benzyl-1-propyl-D-xylo-hexopyranosylamine [French] [ACD/IUPAC Name]
D-xylo-4-Nonulopyranosylamine, N-acetyl-1,2,3-trideoxy-5,6,7,9-tetrakis-O-(phenylmethyl)-, (8ξ)- [ACD/Index Name]
N-((3R,4S,5R)-3,4,5-Tris(benzyloxy)-6-(benzyloxymethyl)-2-propyltetrahydro-2H-pyran-2-yl)acetamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 753.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.7±3.0 kJ/mol
Flash Point: 409.2±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 180.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 9.87
ACD/LogD (pH 5.5): 8.29
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 769467.75
ACD/LogD (pH 7.4): 8.29
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 769467.75
Polar Surface Area: 75 Å2
Polarizability: 71.6±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 529.3±5.0 cm3

Click to predict properties on the Chemicalize site


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