ChemSpider 2D Image | 4-Acetyl-2-methoxyphenyl 2-acetamido-3-O-(carboxymethyl)-2-deoxy-4,6-O-(4-methoxybenzylidene)hexopyranoside | C27H31NO11

4-Acetyl-2-methoxyphenyl 2-acetamido-3-O-(carboxymethyl)-2-deoxy-4,6-O-(4-methoxybenzylidene)hexopyranoside

  • Molecular FormulaC27H31NO11
  • Average mass545.535 Da
  • Monoisotopic mass545.189697 Da
  • ChemSpider ID4147081

More details:

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

2-Acétamido-3-O-(carboxyméthyl)-2-désoxy-4,6-O-(4-méthoxybenzylidène)hexopyranoside de 4-acétyl-2-méthoxyphényle [French] [ACD/IUPAC Name]
4-Acetyl-2-methoxyphenyl 2-acetamido-3-O-(carboxymethyl)-2-deoxy-4,6-O-(4-methoxybenzylidene)hexopyranoside [ACD/IUPAC Name]
4-Acetyl-2-methoxyphenyl-2-acetamido-3-O-(carboxymethyl)-2-desoxy-4,6-O-(4-methoxybenzyliden)hexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside, 4-acetyl-2-methoxyphenyl 2-(acetylamino)-3-O-(carboxymethyl)-2-deoxy-4,6-O-[(4-methoxyphenyl)methylene]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 807.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.1±3.0 kJ/mol
Flash Point: 442.2±34.3 °C
Index of Refraction: 1.594
Molar Refractivity: 134.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.90
ACD/LogD (pH 5.5): -0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.08
ACD/LogD (pH 7.4): -1.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 148 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 60.4±5.0 dyne/cm
Molar Volume: 396.3±5.0 cm3

Click to predict properties on the Chemicalize site


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