CAS 1187669-52-8

Ethanone, 2-bromo-1-(3-chloro-4-pyridinyl)-, hydrobromide (1:1)

Description:

Ethanone, 2-bromo-1-(3-chloro-4-pyridinyl)-, hydrobromide (1:1), with the CAS number 1187669-52-8, is a chemical compound characterized by its molecular structure that includes a brominated ethanone moiety and a pyridine ring substituted with a chlorine atom. This compound typically appears as a solid or crystalline substance and is soluble in polar solvents due to the presence of the hydrobromide salt form. The presence of bromine and chlorine atoms in its structure suggests potential reactivity, particularly in nucleophilic substitution reactions. The pyridine ring contributes to its aromatic properties, which can influence its electronic characteristics and biological activity. Such compounds may exhibit pharmacological properties, making them of interest in medicinal chemistry. However, specific safety and handling precautions should be observed due to the potential toxicity associated with halogenated organic compounds. As with any chemical, proper characterization through techniques such as NMR, IR spectroscopy, and mass spectrometry is essential for confirming its identity and purity.

Formula: C₇H₅BrClNO·BrH

InChI: InChI=1S/C7H5BrClNO.BrH/c8-3-7(11)5-1-2-10-4-6(5)9;/h1-2,4H,3H2;1H

InChI key: InChIKey=AWYKAVOVCORZHA-UHFFFAOYSA-N

SMILES: C(CBr)(=O)C=1C(Cl)=CN=CC1.Br

Synonyms:

• Ethanone, 2-bromo-1-(3-chloro-4-pyridinyl)-, hydrobromide (1:1)
• 2-Bromo-1-(3-chloro-4-pyridinyl)ethanone Hydrobromide
• 2-Bromo-1-(3-chloropyridin-4-yl)ethan-1-one hydrobromide

2-Bromo-1-(3-chloropyridin-4-yl)ethan-1-one hydrobromide

CAS: 1187669-52-8

Versatile small molecule scaffold

Formula: C₇H₆Br₂ClNO

Purity: Min. 95%

Molecular weight: 315.39 g/mol

Ref: 3D-MXB66952