ChemSpider 2D Image | 3-Acetylphenyl 2-acetamido-3-O-(1-carboxyethyl)-2-deoxy-4,6-O-(2-methoxybenzylidene)hexopyranoside | C27H31NO10

3-Acetylphenyl 2-acetamido-3-O-(1-carboxyethyl)-2-deoxy-4,6-O-(2-methoxybenzylidene)hexopyranoside

  • Molecular FormulaC27H31NO10
  • Average mass529.536 Da
  • Monoisotopic mass529.194824 Da
  • ChemSpider ID4147354

More details:

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

2-Acétamido-3-O-(1-carboxyéthyl)-2-désoxy-4,6-O-(2-méthoxybenzylidène)hexopyranoside de 3-acétylphényle [French] [ACD/IUPAC Name]
3-Acetylphenyl 2-acetamido-3-O-(1-carboxyethyl)-2-deoxy-4,6-O-(2-methoxybenzylidene)hexopyranoside [ACD/IUPAC Name]
3-Acetylphenyl-2-acetamido-3-O-(1-carboxyethyl)-2-desoxy-4,6-O-(2-methoxybenzyliden)hexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside, 3-acetylphenyl 2-(acetylamino)-3-O-(1-carboxyethyl)-2-deoxy-4,6-O-[(2-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: 769.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.5±3.0 kJ/mol
Flash Point: 419.2±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 132.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.49
ACD/LogD (pH 7.4): -0.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 139 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 58.9±5.0 dyne/cm
Molar Volume: 391.5±5.0 cm3

Click to predict properties on the Chemicalize site


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