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TCI

CAS 4981-63-9

4'-Chlorobutyrophenone TCI C1547

4'-Chlorobutyrophenone TCI C1547

Chemical Identity

Other names
4-Chlorophenyl Propyl Ketone
CAS No.
4981-63-9
PubChem
CID 70321·SID 87566544
Formula
C10H11ClO
Molecular weight
182.65 g/mol
Purity
>98.0%(GC)
Storage
0-10°C
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
1-(4-chlorophenyl)butan-1-one
SMILES
CCCC(=O)C1=CC=C(C=C1)Cl
InChIKey
XLCJPQYALLFIPW-UHFFFAOYSA-N
MDL
MDL00013647
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TCI C1547, 4'-Chlorobutyrophenone (CAS 4981-63-9), is an aryl ketone that pairs a para-chlorinated phenyl ring with a butyryl chain. The butyrophenone framework is a familiar motif in medicinal chemistry, while the carbonyl group supports classical transformations such as reduction to the secondary alcohol and reductive amination. The para-chloro substituent provides an additional handle for nucleophilic aromatic substitution and metal-catalysed cross-coupling. Available from AMI Scientific in a 25 g pack, it should be handled in a fume hood and stored tightly closed in a cool, dry place away from heat and strong oxidisers.

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  • Anilkumar et al. (2005). 4-tert-Butyl-γ-chlorobutyrophenone. Acta Crystallographica Section E Structure Reports Online doi:10.1107/s1600536805028771

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