ChemSpider 2D Image | Methyl 3-[(3-bromo-5-nitro-4-pyridinyl)(methyl)amino]-2-methylpropanoate | C11H14BrN3O4

Methyl 3-[(3-bromo-5-nitro-4-pyridinyl)(methyl)amino]-2-methylpropanoate

  • Molecular FormulaC11H14BrN3O4
  • Average mass332.151 Da
  • Monoisotopic mass331.016754 Da
  • ChemSpider ID30410516

More details:

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

3-[(3-Bromo-5-nitro-4-pyridinyl)(méthyl)amino]-2-méthylpropanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-[(3-bromo-5-nitro-4-pyridinyl)(methyl)amino]-2-methylpropanoate [ACD/IUPAC Name]
Methyl-3-[(3-brom-5-nitro-4-pyridinyl)(methyl)amino]-2-methylpropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3-[(3-bromo-5-nitro-4-pyridinyl)methylamino]-2-methyl-, methyl ester [ACD/Index Name]
1797545-86-8 [RN]
METHYL 3-[(3-BROMO-5-NITROPYRIDIN-4-YL)(METHYL)AMINO]-2-METHYLPROPANOATE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 400.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 196.0±28.7 °C
Index of Refraction: 1.584
Molar Refractivity: 73.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 45.02
ACD/KOC (pH 5.5): 530.91
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 45.06
ACD/KOC (pH 7.4): 531.41
Polar Surface Area: 88 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 218.6±3.0 cm3

Click to predict properties on the Chemicalize site


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