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2-Bromo-5-nitropyridin-4-amine

  • Name 2-Bromo-5-nitropyridin-4-amine
  • EINECSN/A
  • CAS No. 84487-15-0
  • Density1.929 g/cm3
  • PSA84.73000
  • LogP2.43890
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC5H4BrN3O2
  • Boiling Point396.3 °C at 760 mmHg
  • Molecular Weight218.01
  • Flash Point193.5 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 84487-15-0 (2-Bromo-5-nitropyridin-4-amine)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data4

2-Bromo-5-nitropyridin-4-amine Specification

The 2-Bromo-5-nitropyridin-4-amine, with the CAS registry number 84487-15-0, is also known as 4-Pyridinamine, 2-bromo-5-nitro-. This chemical's molecular formula is C5H4BrN3O2 and molecular weight is 218.0082. What's more, its systematic name is 2-Bromo-5-nitro-pyridin-4-amine.

Physical properties about 2-Bromo-5-nitropyridin-4-amine are: (1)ACD/LogP: 2.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.29; (4)ACD/LogD (pH 7.4): 2.29; (5)#H bond acceptors: 5; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 84.73 Å2; (9)Index of Refraction: 1.682; (10)Molar Refractivity: 42.81 cm3; (11)Molar Volume: 112.9 cm3; (12)Polarizability: 16.97×10-24 cm3; (13)Surface Tension: 75.7 dyne/cm; (14)Density: 1.929 g/cm3; (15)Flash Point: 193.5 °C; (16)Enthalpy of Vaporization: 64.66 kJ/mol; (17)Boiling Point: 396.3 °C at 760 mmHg; (18)Vapour Pressure: 1.72E-06 mmHg at 25 °C. 

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(c(cnc1Br)[N+](=O)[O-])N
(2) InChI: InChI=1/C5H4BrN3O2/c6-5-1-3(7)4(2-8-5)9(10)11/h1-2H,(H2,7,8)
(3) InChIKey: KBAXIFACFUIWMK-UHFFFAOYAD

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