Found 22 results

Search term: MF = 'C_{39}H_{45}NO_{6}'
ChemSpider 2D Image | 2,3,4,6-Tetra-O-benzyl-N-pentanoyl-alpha-D-glucopyranosylamine | C39H45NO6

2,3,4,6-Tetra-O-benzyl-N-pentanoyl-α-D-glucopyranosylamine

  • Molecular FormulaC39H45NO6
  • Average mass623.778 Da
  • Monoisotopic mass623.324707 Da
  • ChemSpider ID77422258

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3,4,6-Tetra-O-benzyl-N-pentanoyl-α-D-glucopyranosylamin [German] [ACD/IUPAC Name]
2,3,4,6-Tetra-O-benzyl-N-pentanoyl-α-D-glucopyranosylamine [ACD/IUPAC Name]
2,3,4,6-Tétra-O-benzyl-N-pentanoyl-α-D-glucopyranosylamine [French] [ACD/IUPAC Name]
α-D-Glucopyranosylamine, N-(1-oxopentyl)-2,3,4,6-tetrakis-O-(phenylmethyl)- [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: 761.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.8±3.0 kJ/mol
Flash Point: 414.0±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: 17
#Rule of 5 Violations: 2
ACD/LogP: 9.86
ACD/LogD (pH 5.5): 8.08
ACD/BCF (pH 5.5): 815283.69
ACD/KOC (pH 5.5): 592767.50
ACD/LogD (pH 7.4): 8.08
ACD/BCF (pH 7.4): 815282.81
ACD/KOC (pH 7.4): 592766.81
Polar Surface Area: 75 Å2
Polarizability: 71.6±0.5 10-24cm3
Surface Tension: 52.0±5.0 dyne/cm
Molar Volume: 529.5±5.0 cm3

Click to predict properties on the Chemicalize site


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