6-Chlorohexanoic acid (C6H11ClO2)

Looking for routes to 6-Chlorohexanoic acid? 6-Chlorohexanoic acid presents a C6 framework, a carboxylic acid, halogen substitution. Use the planner with prefilled SMILES, or copy O=C(O)CCCCCCl (CAS 4224-62-8).

Target: 6-Chlorohexanoic acid
CAS: 4224-62-8
Formula: C6H11ClO2
Approx. MW: 150.60
SMILES: O=C(O)CCCCCCl
PubChem CID: 20209
Approx. carbons: C6

6-Chlorohexanoic acid structure

Properties

IUPAC name: 6-chlorohexanoic acid
Common names: 6-Chlorohexanoic acid; 4224-62-8; 6-Chlorocaproic acid; UNII-NWA54WK4TF; HEXANOIC ACID, 6-CHLORO-; BRN 1749733; NWA54WK4TF; 4-02-00-00936 (Beilstein Handbook Reference); XWWKSLXUVZVGSP-UHFFFAOYSA-; DTXSID50195076
Molecular weight: 150.60
Exact mass: 150.04
InChIKey: XWWKSLXUVZVGSP-UHFFFAOYSA-N

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6-Chlorohexanoic acid 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 6-Chlorohexanoic acid?

6-Chlorohexanoic acid has molecular formula C6H11ClO2. Molecular weight about 150.60 g·mol⁻¹.

What is the CAS number of 6-Chlorohexanoic acid?

The CAS Registry Number for 6-Chlorohexanoic acid is 4224-62-8.

Run AI retrosynthesis for 6-Chlorohexanoic acid Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C6H11ClO2.

Related targets

Similar compounds

2-Chloro-4-methylpentanoic acid 2-Bromohexanoic Acid 6-Bromohexanoic Acid 2-(Bromomethyl)acrylic acid 2-(Trifluoromethyl)acrylic acid 2-Bromo-2-methylpropanoic acid

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References & tools

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