chempirical

3-Bromo-2-nitropyridine

C5H3BrN2O2CAS 54231-33-3202.99 g/mol

Open in Covalent MOL file
ON+O−NBr
Aryl halideNitro

Properties

Molecular formula
C5H3BrN2O2
Molar mass
202.99 g/mol
Exact mass
201.9378 Da
logP
1.75Crippen estimate
Polar surface area
56.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Identifiers

CAS number
54231-33-3
SMILES
O=[N+]([O-])c1ncccc1Br
InChIKey
WFNISJZUJCKTLT-UHFFFAOYSA-N
InChI
InChI=1S/C5H3BrN2O2/c6-4-2-1-3-7-5(4)8(9)10/h1-3H

Weigh it out

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Names and synonyms

2 names
  • Pyridine, 3-bromo-2-nitro-
  • 3-Bromo-2-nitropyridin

Work with 3-Bromo-2-nitropyridine

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-Nitro-3-pyridinamine13269-19-761 % similar 3-Hydroxy-2-nitropyridine15128-82-261 % similar 3-Fluoro-2-nitropyridine54231-35-561 % similar 3-Methoxy-2-nitropyridine20265-37-656 % similar 1-Bromo-2-nitrobenzene577-19-555 % similar 3-Nitro-2(1H)-pyridinethione38240-29-851 % similar 2-Amino-3-nitropyridine4214-75-951 % similar 2-Chloro-3-nitropyridine5470-18-851 % similar

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

Same formula

3-Bromo-5-nitropyridine15862-30-3 5-Bromo-2-nitropyridine39856-50-3 2-Bromo-5-nitropyridine4487-59-6

Elsewhere

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