ChemSpider 2D Image | Methyl 3-bromo-4-({1-[(methylcarbamoyl)amino]-1-oxo-2-propanyl}oxy)benzoate | C13H15BrN2O5

Methyl 3-bromo-4-({1-[(methylcarbamoyl)amino]-1-oxo-2-propanyl}oxy)benzoate

  • Molecular FormulaC13H15BrN2O5
  • Average mass359.173 Da
  • Monoisotopic mass358.016418 Da
  • ChemSpider ID21937172

More details:

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

3-Bromo-4-({1-[(méthylcarbamoyl)amino]-1-oxo-2-propanyl}oxy)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-4-[1-methyl-2-[[(methylamino)carbonyl]amino]-2-oxoethoxy]-, methyl ester [ACD/Index Name]
Methyl 3-bromo-4-({1-[(methylcarbamoyl)amino]-1-oxo-2-propanyl}oxy)benzoate [ACD/IUPAC Name]
Methyl-3-brom-4-({1-[(methylcarbamoyl)amino]-1-oxo-2-propanyl}oxy)benzoat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.549
Molar Refractivity: 78.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 26.98
ACD/KOC (pH 5.5): 368.07
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.89
ACD/KOC (pH 7.4): 366.86
Polar Surface Area: 94 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 245.8±3.0 cm3

Click to predict properties on the Chemicalize site


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