chempirical

2,5-Dichloro-3-nitropyridine

C5H2Cl2N2O2CAS 21427-62-3192.98 g/mol

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

Properties

Molecular formula
C5H2Cl2N2O2
Molar mass
192.98 g/mol
Exact mass
191.9493 Da
Melting point
110–115 °C
logP
2.30Crippen estimate
Polar surface area
56.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Identifiers

CAS number
21427-62-3
SMILES
O=[N+]([O-])c1cc(Cl)cnc1Cl
InChIKey
OBUGJYJQJWMOQO-UHFFFAOYSA-N
InChI
InChI=1S/C5H2Cl2N2O2/c6-3-1-4(9(10)11)5(7)8-2-3/h1-2H

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Names and synonyms

2 names
  • Pyridine, 2,5-dichloro-3-nitro-
  • 3-Nitro-2,5-dichloropyridine

Work with 2,5-Dichloro-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-Chloro-3,5-dinitropyridine2578-45-270 % similar 5-Chloro-2-methyl-3-nitropyridine1211533-93-566 % similar 2-Chloro-5-methyl-3-nitropyridine23056-40-866 % similar 2-Chloro-5-iodo-3-nitropyridine426463-05-066 % similar Methyl 6-chloro-5-nitro-3-pyridinecarboxylate59237-53-553 % similar 4-Chloro-1,2-dinitrobenzene610-40-253 % similar 2-Chloro-3-nitropyridine5470-18-853 % similar 1,4-Dichloro-2-nitrobenzene89-61-250 % similar

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

Same formula

4,6-Dichloro-3-pyridazinecarboxylic acid1040246-87-4 2,6-Dichloro-3-nitropyridine16013-85-7 2,3-Dichloro-5-nitropyridine22353-40-8

Elsewhere

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