4-Chloro-2-hydroxy-3-nitropyridine

C₅H₃ClN₂O₃CAS 165547-79-5174.54 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₅H₃ClN₂O₃
Molar mass: 174.54 g/mol
Exact mass: 173.9832 Da
logP: 0.94Crippen estimate
Polar surface area: 76.0 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

165547-79-5

SMILES

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

InChIKey

UKIZCTHOMJXNIX-UHFFFAOYSA-N

InChI

InChI=1S/C5H3ClN2O3/c6-3-1-2-7-5(9)4(3)8(10)11/h1-2H,(H,7,9)

Weigh it out

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

Names and synonyms

1 names

4-Chloro-3-nitro-1,2-dihydropyridin-2-one

Work with 4-Chloro-2-hydroxy-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

1-Chloro-3-methyl-2-nitrobenzene5367-26-047 % similar 3-Chloro-2-nitrobenzenamine59483-54-447 % similar 1-Chloro-3-fluoro-2-nitrobenzene64182-61-247 % similar 1,2,4,5-Tetrachloro-3-nitrobenzene117-18-044 % similar 2,4,6-Trichloronitrobenzene18708-70-844 % similar 1,3,5-Trichloro-2,4-dinitrobenzene6284-83-944 % similar 3-Chloro-2-nitrobenzoic acid4771-47-542 % similar 2,4-Dichloronitrobenzene611-06-341 % similar

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

Same formula

2-Chloro-4-nitropyridine N-oxide14432-16-7 3-Chloro-5-nitro-2(1H)-pyridinone22353-38-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook