3-Chloropropiophenone TCI C0995

Chemical Identity

Other names: 3-Chloro-1-phenyl-1-propanone
CAS No.: 936-59-4
PubChem: CID 70295·SID 87566040
Formula: C9H9ClO
Molecular weight: 168.62 g/mol
Purity: >96.0%(GC)
Reference databases: ChEBI·ECHA

Full identifiers (IUPAC, SMILES, InChIKey)

IUPAC: 3-chloro-1-phenylpropan-1-one
SMILES: C1=CC=C(C=C1)C(=O)CCCl
InChIKey: KTJRGPZVSKWRTJ-UHFFFAOYSA-N
MDL: MDL00000990

Rp 1.776.600,00

~~Rp 1.257.900,00~~ Rp 1.776.600,00

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TCI C0995 3-Chloropropiophenone (CAS 936-59-4) is a versatile β-chloroketone building block combining an aryl ketone with a readily displaced beta chlorine atom. Chemists commonly use it to prepare β-aminoketones by substitution with amines, or to generate a reactive Michael acceptor in situ through HCl elimination. Selective carbonyl reduction also provides chlorohydrin intermediates that support downstream and asymmetric synthesis work. AMI Scientific supplies this TCI reagent in a 25 g research pack; keep it tightly closed in a cool, dry place away from moisture and strong bases.

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Chen et al. (2014). 2-Bromo-3′-chloropropiophenone is a genotoxic impurity. Toxicology Letters doi:10.1016/j.toxlet.2014.06.682
Sonneck et al. (2025). 3-Chloropropiophenone. IUCrData doi:10.1107/s2414314625003499
Usui et al. (1998). Stereoselectivities in AgBF4-catalyzed and photoinduced phenyl-rearrangement of 2-chloropropiophenone. Tetrahedron Letters doi:10.1016/s0040-4039(98)02284-9

References were compiled automatically from Crossref and every DOI was verified to exist. AMI Scientific is not affiliated with the authors or the publishers.