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TCI

CAS 111-85-3

1-Chlorooctane TCI C0236

1-Chlorooctane TCI C0236

Chemical Identity

Other names
n-Octyl Chloride
CAS No.
111-85-3
Formula
C8H17Cl
Molecular weight
148.67 g/mol
Purity
>99.0%(GC)
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
1-chlorooctane
SMILES
CCCCCCCCCl
InChIKey
CNDHHGUSRIZDSL-UHFFFAOYSA-N
MDL
MDL00001022
PubChem
CID 8142
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TCI C0236 1-Chlorooctane (CAS 111-85-3) is a straight-chain primary alkyl chloride used as a versatile non-heterocyclic building block. It serves as a convenient precursor to octylmagnesium chloride and as an alkylating agent for introducing an eight-carbon chain onto nucleophilic substrates. The reagent is also valued in surfactant and quaternary ammonium salt preparation, where its hydrophobic tail is essential. AMI Scientific offers this TCI product in 25 mL and 500 mL bottles to suit both exploratory and routine synthetic work.

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  • Singh et al. (2010). Vibrational analysis of 1-chlorooctane. Indian Journal of Physics doi:10.1007/s12648-010-0116-x
  • Hara et al. (2024). Temperature-dependent chlorosomal self-aggregation of bacteriochlorophyll-d analogs with a branched alkyl chain in a single 1-chlorooctane solvent. Bulletin of the Chemical Society of Japan doi:10.1093/bulcsj/uoae032
  • Rolińska et al. (2004). Solubilities of Some Long-Chain n-Alkanes in Dipropyl Ether, Dibutyl Ether, 1-Chlorobutane, and 1-Chlorooctane as Functions of Temperature. Journal of Chemical & Engineering Data doi:10.1021/je030206q

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