ChemSpider 2D Image | Methyl 6-O-acetyl-3-O-benzyl-2-{[(benzyloxy)carbonyl]amino}-2-deoxyhexopyranoside | C24H29NO8

Methyl 6-O-acetyl-3-O-benzyl-2-{[(benzyloxy)carbonyl]amino}-2-deoxyhexopyranoside

  • Molecular FormulaC24H29NO8
  • Average mass459.489 Da
  • Monoisotopic mass459.189331 Da
  • ChemSpider ID57463265

More details:

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

6-O-Acétyl-3-O-benzyl-2-{[(benzyloxy)carbonyl]amino}-2-désoxyhexopyranoside de méthyle [French] [ACD/IUPAC Name]
Hexopyranoside, methyl 2-deoxy-2-[[(phenylmethoxy)carbonyl]amino]-3-O-(phenylmethyl)-, 6-acetate [ACD/Index Name]
Methyl 6-O-acetyl-3-O-benzyl-2-{[(benzyloxy)carbonyl]amino}-2-deoxyhexopyranoside [ACD/IUPAC Name]
Methyl-6-O-acetyl-3-O-benzyl-2-{[(benzyloxy)carbonyl]amino}-2-desoxyhexopyranosid [German] [ACD/IUPAC Name]
[4-(BENZYLOXY)-5-{[(BENZYLOXY)CARBONYL]AMINO}-3-HYDROXY-6-METHOXYOXAN-2-YL]METHYL ACETATE
Methyl 2-deoxy-2-[[(phenylmethoxy)carbonyl]amino]-3-O-(phenylmethyl)-α-D-glucopyranoside 6-acetate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 625.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 332.0±31.5 °C
Index of Refraction: 1.577
Molar Refractivity: 119.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.37
ACD/LogD (pH 5.5): 3.41
ACD/BCF (pH 5.5): 229.63
ACD/KOC (pH 5.5): 1704.60
ACD/LogD (pH 7.4): 3.41
ACD/BCF (pH 7.4): 229.23
ACD/KOC (pH 7.4): 1701.68
Polar Surface Area: 113 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 54.6±5.0 dyne/cm
Molar Volume: 359.0±5.0 cm3

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