549940

6-Chlorohexanoyl chloride

96%

• Linear Formula: Cl(CH₂)₅COCl
• CAS Number: 19347-73-0
• Molecular Weight: 169.05
• EC Number: 242-979-9
• MDL number: MFCD00041436
• UNSPSC Code: 12352100
• PubChem Substance ID: 24874734
• NACRES: NA.22

Properties

• assay: 96%
• refractive index: n20/D 1.4640 (lit.)
• density: 1.400 g/mL at 25 °C (lit.)
• SMILES string: ClCCCCCC(Cl)=O
• InChI: 1S/C6H10Cl2O/c7-5-3-1-2-4-6(8)9/h1-5H2
• InChI key: WZILXAPNPKMOSA-UHFFFAOYSA-N

Description

Application

6-Chlorohexanoyl chloride may be used in the following processes:

• Preparation of tert-butyl-N-(2-(6-chlorovaleryl)phenyl)carbamate, an intermediate for synthesizing the ketone analog of 2-amino-N-(4-(4-(1,2-benzisothiazol-3-yl)-1-piperazinyl)-butyl)benzamide hydrochloride.
• Preparation of (S)-(-)6-chlorohexanoic acid (2-methoxymethylpyrrolidin-1-yl)amide, a precursor for synthesizing 2-alkyl-substituted lactones.
• Deprotection and acylation of the pendant nitrogen during the preparation of a new cryptand with hydroxamate moiety that can bind with tribasic cations.

Safety Information

• pictograms: GHS05
• signalword: Danger
• hcodes: H314
• pcodes: P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363 - P405
• Hazard Classifications: Eye Dam. 1 - Skin Corr. 1B
• supp_hazards: EUH014
• Storage Class: 8A - Combustible corrosive hazardous materials
• wgk_germany: WGK 3
• flash_point_f: 230.0 °F - closed cup
• flash_point_c: 110 °C - closed cup
• ppe: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter