ChemSpider 2D Image | Ethyl N-acetyl-N-(5-bromo-4-methoxy-6-methyl-2-pyrimidinyl)glycinate | C12H16BrN3O4

Ethyl N-acetyl-N-(5-bromo-4-methoxy-6-methyl-2-pyrimidinyl)glycinate

  • Molecular FormulaC12H16BrN3O4
  • Average mass346.177 Da
  • Monoisotopic mass345.032410 Da
  • ChemSpider ID21675906

More details:

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

Ethyl N-acetyl-N-(5-bromo-4-methoxy-6-methyl-2-pyrimidinyl)glycinate [ACD/IUPAC Name]
Ethyl-N-acetyl-N-(5-brom-4-methoxy-6-methyl-2-pyrimidinyl)glycinat [German] [ACD/IUPAC Name]
Glycine, N-acetyl-N-(5-bromo-4-methoxy-6-methyl-2-pyrimidinyl)-, ethyl ester [ACD/Index Name]
N-Acétyl-N-(5-bromo-4-méthoxy-6-méthyl-2-pyrimidinyl)glycinate d'éthyle [French] [ACD/IUPAC Name]
ethyl 2-[N-(5-bromo-4-methoxy-6-methylpyrimidin-2-yl)acetamido]acetate
ethyl N-acetyl-N-(5-bromo-4-methoxy-6-methylpyrimidin-2-yl)glycinate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 451.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 227.1±31.5 °C
Index of Refraction: 1.557
Molar Refractivity: 76.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.68
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 6.97
ACD/KOC (pH 5.5): 139.63
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.97
ACD/KOC (pH 7.4): 139.63
Polar Surface Area: 82 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 237.0±3.0 cm3

Click to predict properties on the Chemicalize site


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