2-Chloro-4-methyl-5-nitropyridine

C₆H₅ClN₂O₂CAS 23056-33-9172.57 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₆H₅ClN₂O₂
Molar mass: 172.57 g/mol
Exact mass: 172.0040 Da
Melting point: 38.5–39.5 °C
Boiling point: 91.2 °C (at 5 Torr)
logP: 1.95Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

23056-33-9

SMILES

Cc1cc(Cl)ncc1[N+](=O)[O-]

InChIKey

HWZUMEVIIGNXGM-UHFFFAOYSA-N

InChI

InChI=1S/C6H5ClN2O2/c1-4-2-6(7)8-3-5(4)9(10)11/h2-3H,1H3

Weigh it out

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

Names and synonyms

5 names

Pyridine, 2-chloro-4-methyl-5-nitro-
4-Picoline, 2-chloro-5-nitro-
2-Chloro-5-nitro-4-methylpyridine
NSC 402978
2-Chloro-5-nitro-4-picoline

Work with 2-Chloro-4-methyl-5-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

4-Methyl-5-nitro-2(1H)-pyridinone21901-41-762 % similar 2-Bromo-4-methyl-5-nitropyridine23056-47-562 % similar 4-Methyl-3-nitropyridine5832-44-054 % similar 4-Chloro-2-methyl-1-nitrobenzene5367-28-253 % similar 4-Chloro-1-methyl-2-nitrobenzene89-59-853 % similar 2-Chloro-5-methyl-3-nitropyridine23056-40-850 % similar 1-Chloro-2-fluoro-4-methyl-5-nitrobenzene118664-99-649 % similar 2-Chloro-5-nitropyridine4548-45-249 % similar

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

Same formula

Methyl 6-chloropyridazine-4-carboxylate1093860-48-0 5-Chloro-2-methyl-3-nitropyridine1211533-93-5 2-Chloro-4-nitroaniline121-87-9 Methyl 2-chloropyrimidine-4-carboxylate149849-94-5 5-Chloro-2-nitroaniline1635-61-6 2-Chloro-3-methyl-5-nitropyridine22280-56-4 6-Chloro-2-methyl-3-nitropyridine22280-60-0 2-Chloro-4-methyl-3-nitropyridine23056-39-5

Elsewhere

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