chempirical

2-Chloro-5-acetylpyridine

C7H6ClNOCAS 55676-22-7155.58 g/mol

Open in Covalent MOL file
ONCl
Aryl halideKetone

Properties

Molecular formula
C7H6ClNO
Molar mass
155.58 g/mol
Exact mass
155.0138 Da
logP
1.94Crippen estimate
Polar surface area
30.0 Ų
H-bond donors / acceptors
0 / 2
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
55676-22-7
SMILES
CC(=O)C1=CN=C(C=C1)Cl
InChIKey
UXSNZYGTQTXRAD-UHFFFAOYSA-N
InChI
InChI=1S/C7H6ClNO/c1-5(10)6-2-3-7(8)9-4-6/h2-4H,1H3

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Names and synonyms

1 names
  • 1-(6-Chloropyridin-3-yl)ethan-1-one

Work with 2-Chloro-5-acetylpyridine

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-(6-Methyl-3-pyridinyl)ethanone36357-38-759 % similar 6-Chloronicotinoyl chloride58757-38-359 % similar 1-(6-Bromo-pyridin-3-yl)-ethanone139042-59-458 % similar 6-Chloronicotinic acid5326-23-858 % similar Methyl 6-chloropyridine-3-carboxylate73781-91-657 % similar 5-Acetyl-2-methoxypyridine213193-32-954 % similar 1-[6-(Trifluoromethyl)pyridin-3-yl]ethanone358780-14-054 % similar 6-Chloropyridine-3-carbohydrazide168893-66-153 % similar

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

Same formula

2-Amino-5-chlorobenzaldehyde20028-53-9 1-(2-Chloro-pyridin-4-yl)-ethanone23794-15-2 2-Chlorobenzaldehyde oxime3717-28-0 3-Acetyl-2-chloropyridine55676-21-6 2-Chlorobenzamide609-66-5 3-Chlorobenzamide618-48-4 4-Chlorobenzamide619-56-7 N-Hydroxybenzenecarboximidoyl chloride698-16-8

Elsewhere

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