Found 22 results

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

2,3,4,6-Tetra-O-benzyl-N-(3-methylbutanoyl)-α-D-galactopyranosylamine

  • Molecular FormulaC39H45NO6
  • Average mass623.778 Da
  • Monoisotopic mass623.324707 Da
  • ChemSpider ID9839236

  • 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-(3-methylbutanoyl)-α-D-galactopyranosylamin [German] [ACD/IUPAC Name]
2,3,4,6-Tetra-O-benzyl-N-(3-methylbutanoyl)-α-D-galactopyranosylamine [ACD/IUPAC Name]
2,3,4,6-Tétra-O-benzyl-N-(3-méthylbutanoyl)-α-D-galactopyranosylamine [French] [ACD/IUPAC Name]
α-D-Galactopyranosylamine, N-(3-methyl-1-oxobutyl)-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: 757.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.3±3.0 kJ/mol
Flash Point: 411.7±32.9 °C
Index of Refraction: 1.597
Molar Refractivity: 180.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 9.67
ACD/LogD (pH 5.5): 8.02
ACD/BCF (pH 5.5): 737998.25
ACD/KOC (pH 5.5): 551980.56
ACD/LogD (pH 7.4): 8.02
ACD/BCF (pH 7.4): 737997.44
ACD/KOC (pH 7.4): 551980.00
Polar Surface Area: 75 Å2
Polarizability: 71.6±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 530.2±5.0 cm3

Click to predict properties on the Chemicalize site


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