5-Bromo-4-chloro-3-nitro-2-pyridinamine

C₅H₃BrClN₃O₂CAS 942947-95-7252.45 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₅H₃BrClN₃O₂
Molar mass: 252.45 g/mol
Exact mass: 250.9097 Da
logP: 1.82Crippen estimate
Polar surface area: 82.8 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Identifiers

CAS number

942947-95-7

SMILES

N=c1[nH]cc(Br)c(Cl)c1[N+](=O)[O-]

InChIKey

BLGCPXIDEMLKMS-UHFFFAOYSA-N

InChI

InChI=1S/C5H3BrClN3O2/c6-2-1-9-5(8)4(3(2)7)10(11)12/h1H,(H2,8,9)

Weigh it out

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

Names and synonyms

3 names

2-Pyridinamine, 5-bromo-4-chloro-3-nitro-
2-Amino-5-bromo-4-chloro-3-nitropyridine
5-Bromo-4-chloro-3-nitropyridin-2-amine

Work with 5-Bromo-4-chloro-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

5-Bromo-4-chloro-2,3-pyridinediamine1131604-99-350 % similar 1-Bromo-2-chloro-3-nitrobenzene3970-37-444 % similar 4,6-Diamino-5-nitropyrimidine2164-84-342 % similar Pentachloronitrobenzene82-68-842 % similar 1,2,4,5-Tetrachloro-3-nitrobenzene117-18-040 % similar 1,3,5-Trichloro-2,4-dinitrobenzene6284-83-940 % similar 1-Bromo-3-fluoro-2-nitrobenzene886762-70-540 % similar 1-Bromo-4-chloro-2-nitrobenzene41513-04-639 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook