ChemSpider 2D Image | Ethyl 4-acetyl-5-methyl-2-{[N-(3,4,5-trimethoxybenzoyl)glycyl]amino}-3-furoate | C22H26N2O9

Ethyl 4-acetyl-5-methyl-2-{[N-(3,4,5-trimethoxybenzoyl)glycyl]amino}-3-furoate

  • Molecular FormulaC22H26N2O9
  • Average mass462.450 Da
  • Monoisotopic mass462.163818 Da
  • ChemSpider ID34718965

More details:

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

3-Furancarboxylic acid, 4-acetyl-5-methyl-2-[[2-[(3,4,5-trimethoxybenzoyl)amino]acetyl]amino]-, ethyl ester [ACD/Index Name]
4-Acétyl-5-méthyl-2-{[N-(3,4,5-triméthoxybenzoyl)glycyl]amino}-3-furoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-acetyl-5-methyl-2-{[N-(3,4,5-trimethoxybenzoyl)glycyl]amino}-3-furoate [ACD/IUPAC Name]
Ethyl-4-acetyl-5-methyl-2-{[N-(3,4,5-trimethoxybenzoyl)glycyl]amino}-3-furoat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 640.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.5±3.0 kJ/mol
Flash Point: 341.1±31.5 °C
Index of Refraction: 1.557
Molar Refractivity: 117.3±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 9.75
ACD/KOC (pH 5.5): 177.63
ACD/LogD (pH 7.4): 1.60
ACD/BCF (pH 7.4): 9.75
ACD/KOC (pH 7.4): 177.62
Polar Surface Area: 142 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 364.3±3.0 cm3

Click to predict properties on the Chemicalize site


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