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ChemSpider 2D Image | 4-Nitrophenyl 2-acetamido-2-deoxy-4,6-O-(4-methoxybenzylidene)-alpha-D-galactopyranoside | C22H24N2O9

4-Nitrophenyl 2-acetamido-2-deoxy-4,6-O-(4-methoxybenzylidene)-α-D-galactopyranoside

  • Molecular FormulaC22H24N2O9
  • Average mass460.434 Da
  • Monoisotopic mass460.148193 Da
  • ChemSpider ID30783176
  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

2-Acétamido-2-désoxy-4,6-O-(4-méthoxybenzylidène)-α-D-galactopyranoside de 4-nitrophényle [French] [ACD/IUPAC Name]
4-Nitrophenyl 2-acetamido-2-deoxy-4,6-O-(4-methoxybenzylidene)-α-D-galactopyranoside [ACD/IUPAC Name]
4-Nitrophenyl-2-acetamido-2-desoxy-4,6-O-(4-methoxybenzyliden)-α-D-galactopyranosid [German] [ACD/IUPAC Name]
α-D-Galactopyranoside, 4-nitrophenyl 2-(acetylamino)-2-deoxy-4,6-O-[(4-methoxyphenyl)methylene]- [ACD/Index Name]
4-Nitrophenyl 2-acetamido-2-deoxy-4,6-O-[(4-methoxyphenyl)methylidene]-α-D-galactopyranoside
4-Nitrophenyl 2-acetamido-2-deoxy-4,6-O-p-methoxybenzylidene-a-D-galactopyranoside
4-Nitrophenyl 2-acetamido-2-deoxy-4,6-O-p-methoxybenzylidene-α-D-galactopyranoside
4-Nitrophenyl 2-AcetaMido-4,6-O-Methoxybenzylidene-2-deoxy-??-D-galactopyranoside

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 753.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.2±3.0 kJ/mol
Flash Point: 409.4±32.9 °C
Index of Refraction: 1.623
Molar Refractivity: 113.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 44.75
ACD/KOC (pH 5.5): 528.72
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 44.75
ACD/KOC (pH 7.4): 528.72
Polar Surface Area: 141 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 64.8±5.0 dyne/cm
Molar Volume: 322.2±5.0 cm3

Click to predict properties on the Chemicalize site