2-Chloro-5-methyl-3-nitropyridine

C₆H₅ClN₂O₂CAS 23056-40-8172.57 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: 50–51 °C
logP: 1.95Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

23056-40-8

SMILES

Cc1cnc(Cl)c([N+](=O)[O-])c1

InChIKey

LUAJUWOJEFFNFE-UHFFFAOYSA-N

InChI

InChI=1S/C6H5ClN2O2/c1-4-2-5(9(10)11)6(7)8-3-4/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-5-methyl-3-nitro-
3-Picoline, 6-chloro-5-nitro-
5-Methyl-2-chloro-3-nitropyridine
5-Methyl-3-nitro-2-chloropyridine
2-Chloro-3-nitro-5-methylpyridine

Work with 2-Chloro-5-methyl-3-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

2,5-Dichloro-3-nitropyridine21427-62-366 % similar 2-Chloro-3,5-dinitropyridine2578-45-266 % similar 2-Chloro-5-iodo-3-nitropyridine426463-05-062 % similar 2-Chloro-5-methyl-1,3-dinitrobenzene5264-65-357 % similar Methyl 6-chloro-5-nitro-3-pyridinecarboxylate59237-53-555 % similar 4-Chloro-3-nitrotoluene89-60-153 % similar 3-Bromo-6-chloro-2-methyl-5-nitropyridine186413-75-250 % similar 2-Chloro-4-methyl-1-nitrobenzene38939-88-750 % 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-5-nitropyridine23056-33-9

Elsewhere

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