ChemSpider 2D Image | 2-[(4-Fluoro-2-nitrophenyl)amino]-2-oxoethyl N-(4-butoxybenzoyl)glycinate | C21H22FN3O7

2-[(4-Fluoro-2-nitrophenyl)amino]-2-oxoethyl N-(4-butoxybenzoyl)glycinate

  • Molecular FormulaC21H22FN3O7
  • Average mass447.414 Da
  • Monoisotopic mass447.144165 Da
  • ChemSpider ID33999673

More details:

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

2-[(4-Fluor-2-nitrophenyl)amino]-2-oxoethyl-N-(4-butoxybenzoyl)glycinat [German] [ACD/IUPAC Name]
2-[(4-Fluoro-2-nitrophenyl)amino]-2-oxoethyl N-(4-butoxybenzoyl)glycinate [ACD/IUPAC Name]
Glycine, N-(4-butoxybenzoyl)-, 2-[(4-fluoro-2-nitrophenyl)amino]-2-oxoethyl ester [ACD/Index Name]
N-(4-Butoxybenzoyl)glycinate de 2-[(4-fluoro-2-nitrophényl)amino]-2-oxoéthyle [French] [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: 693.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 372.9±31.5 °C
Index of Refraction: 1.586
Molar Refractivity: 111.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 172.23
ACD/KOC (pH 5.5): 1387.41
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 171.99
ACD/KOC (pH 7.4): 1385.49
Polar Surface Area: 140 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 333.3±3.0 cm3

Click to predict properties on the Chemicalize site


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