chempirical

5-Bromo-3-nitro-2-pyridinamine

C5H4BrN3O2CAS 6945-68-2218.01 g/mol

Open in Covalent MOL file
H2NNBrN+OO−
Aryl halideNitroPrimary amine

Properties

Molecular formula
C5H4BrN3O2
Molar mass
218.01 g/mol
Exact mass
216.9487 Da
Melting point
205 °C
logP
1.33Crippen estimate
Polar surface area
82.0 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
1

Identifiers

CAS number
6945-68-2
SMILES
Nc1ncc(Br)cc1[N+](=O)[O-]
InChIKey
QOOCOFOGYRQPPN-UHFFFAOYSA-N
InChI
InChI=1S/C5H4BrN3O2/c6-3-1-4(9(10)11)5(7)8-2-3/h1-2H,(H2,7,8)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 2-Pyridinamine, 5-bromo-3-nitro-
  • Pyridine, 2-amino-5-bromo-3-nitro-
  • 2-Amino-5-bromo-3-nitropyridine
  • 5-Bromo-3-nitropyridin-2-ylamine
  • NSC 52200
  • 5-Bromo-3-nitropyridin-2-amine

Work with 5-Bromo-3-nitro-2-pyridinamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,5-Dibromo-3-nitropyridine15862-37-066 % similar 5-Bromo-3-nitro-2(1H)-pyridinone15862-34-762 % similar 5-Iodo-3-nitro-2-pyridinamine25391-57-562 % similar 5-Bromo-2-methyl-3-nitropyridine911434-05-462 % similar 4-Bromo-2-nitroaniline875-51-457 % similar 4-Bromo-1,2-dinitrobenzene610-38-854 % similar 2,5-Dibromonitrobenzene3460-18-251 % similar 5-Bromo-2-nitropyridine39856-50-351 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Bromo-5-nitro-2-pyridinamine15862-31-4 3-Amino-6-bromo-2-pyrazinecarboxylic acid486424-37-7 6-Bromo-3-nitro-2-pyridinamine84487-04-7

Elsewhere

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