2,4-Dichloro-3-nitropyridine

C₅H₂Cl₂N₂O₂CAS 5975-12-2192.98 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₅H₂Cl₂N₂O₂
Molar mass: 192.98 g/mol
Exact mass: 191.9493 Da
logP: 2.30Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

5975-12-2

SMILES

C1=CN=C(C(=C1Cl)[N+](=O)[O-])Cl

InChIKey

RTXYIHGMYDJHEU-UHFFFAOYSA-N

InChI

InChI=1S/C5H2Cl2N2O2/c6-3-1-2-8-5(7)4(3)9(10)11/h1-2H

Weigh it out

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Work with 2,4-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-4-methyl-3-nitropyridine23056-39-566 % similar 4-Amino-2-chloro-3-nitropyridine2789-25-566 % similar 2-Amino-4-chloro-3-nitropyridine6980-08-166 % similar 4,6-Dichloro-5-nitropyrimidine4316-93-259 % similar 1,3-Dichloro-2-nitrobenzene601-88-758 % similar 2-Chloro-3-nitropyridine34515-82-753 % similar 2-Chloro-3-nitropyridine5470-18-853 % similar 2,4-Dichloro-6-methyl-3-nitropyridine63897-12-151 % 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 2,5-Dichloro-3-nitropyridine21427-62-3 2,3-Dichloro-5-nitropyridine22353-40-8 2,4-Dichloro-5-nitropyridine4487-56-3 3,6-Dichloropyridazine-4-carboxylic acid51149-08-7 3,5-Dichloro-2-nitropyridine610278-88-1 4,6-Dichloropyrimidine-5-carboxylic acid87600-98-4

Elsewhere

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