5-Chloro-2-pentanone (C5H9ClO)

Looking for routes to 5-Chloro-2-pentanone? 5-Chloro-2-pentanone presents a C5 framework, halogen substitution. Use the planner with prefilled SMILES, or copy CC(=O)CCCCl (CAS 5891-21-4).

Target: 5-Chloro-2-pentanone
CAS: 5891-21-4
Formula: C5H9ClO
Approx. MW: 120.58
SMILES: CC(=O)CCCCl
PubChem CID: 79993
Approx. carbons: C5

5-Chloro-2-pentanone structure

Properties

IUPAC name: 5-chloropentan-2-one
Common names: 5-Chloro-2-pentanone; 5-Chloropentan-2-one; 5891-21-4; 2-Pentanone, 5-chloro-; 1-Chloro-4-pentanone; 3-Chloropropyl methyl ketone; 2-Pentanone 5-chloro-; EINECS 227-565-8; DTXSID9064053; XVRIEWDDMODMGA-UHFFFAOYSA-
Molecular weight: 120.58
Exact mass: 120.03
InChIKey: XVRIEWDDMODMGA-UHFFFAOYSA-N

View on PubChem

5-Chloro-2-pentanone 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 5-Chloro-2-pentanone?

5-Chloro-2-pentanone has molecular formula C5H9ClO. Molecular weight about 120.58 g·mol⁻¹.

What is the CAS number of 5-Chloro-2-pentanone?

The CAS Registry Number for 5-Chloro-2-pentanone is 5891-21-4.

Run AI retrosynthesis for 5-Chloro-2-pentanone Target catalog AI tools overview

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Related targets

Similar compounds

(RS)-2-Methylbutyryl chloride Isovaleryl chloride Tetrahydrofurfuryl chloride Valeryl chloride 1-Bromo-3-Methylbutane 1-Bromo-5-chloropentane

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References & tools

ChemicalHelper Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.