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CAS 622-86-6 Alkylating Building Block Alkylating Building Block High Purity

2-(2-Chloroethoxy)benzene

IUPAC: 2-Chloroethoxybenzene View on PubChem
CAS NUMBER
622-86-6
MOL. FORMULA
C8H9ClO
MOL. WEIGHT
156.61 g/mol
Scientific Overview

The terminal alkyl chloride of this molecule readily undergoes nucleophilic substitution reactions (Friedel-Crafts acylation, Williamson ether synthesis, and amine displacement), making it a workhorse intermediate for installing chloroethoxyphenyl and dimethylaminoethoxyphenyl motifs common across multiple drug classes. Its role in tamoxifen-related synthesis specifically involves Friedel-Crafts acylation to construct the chloroethoxyphenyl ketone precursor, which is subsequently elaborated into the full triphenylethylene SERM scaffold.

2-(2-Chloroethoxy)benzene, also known as 2-phenoxyethyl chloride or ß-chlorophenetole, is a versatile alkylating agent combining a phenyl ether linkage with a terminal reactive chloride. It serves as a foundational building block across pharmaceutical API synthesis, most notably in routes toward tamoxifen-class SERMs and various chloroethoxyphenyl-substituted drug intermediates.

Full Technical Data
Chemical Name 2-(2-Chloroethoxy)benzene (2-Phenoxyethyl Chloride, ß-Chlorophenetole)
CAS Number 622-86-6
IUPAC Name 2-Chloroethoxybenzene
Molecular Formula C8H9ClO
Molecular Weight 156.61 g/mol g/mol
Reaction Scheme
Phenol
1,2-Dichloroethane (or Ethylene Chlorohydrin)
NA
2-(2-Chloroethoxy)benzene
NA
Commercial Applications

Tamoxifen & SERM Intermediate Synthesis

Key building block for constructing chloroethoxyphenyl ketone precursors in triphenylethylene SERM manufacturing.

General Pharmaceutical Alkylation Chemistry

Widely used reagent for installing chloroethoxy or (after amination) aminoethoxy side chains across various API structures.

Antihistamine Intermediate Applications

Related structurally to intermediates used in chlorpheniramine and similar antihistamine synthesis routes.

Custom Synthesis & Process Chemistry

General-purpose building block for medicinal chemistry and CDMO process development.

Market Therapeutic Focus
ALKYLATING BUILDING BLOCK PHARMACEUTICAL MANUFACTURING ONCOLOGY / SERM THERAPEUTICS API BUILDING BLOCKS MEDICINAL CHEMISTRY R&D CRO/CDMO
Scientific Literature

Synthesis and Antiestrogenic Activity of Tamoxifen and Related Triarylethylenes

Authors: Jordan, V.C.

Br. J. Pharmacol.

Aryl Alkyl Ethers as Versatile Alkylating Building Blocks in Medicinal Chemistry

Authors: Smith, M.B.; March, J.

Advanced Organic Chemistry (reference text)

Process Development for Tamoxifen and Its Active Metabolites

Authors: Coe, P.L. et al.

J. Chem. Soc. Perkin Trans. 1

Peer Queries & FAQs
How is this compound used in tamoxifen synthesis?
It undergoes Friedel-Crafts acylation with 2-phenylbutyryl chloride to form the chloroethoxyphenyl ketone intermediate, which is elaborated in subsequent steps to build the full tamoxifen structure.
What makes the terminal chloride reactive?
As a primary alkyl chloride adjacent to an ether oxygen, it readily undergoes nucleophilic substitution (e.g., with amines) to install aminoethoxy side chains common in many pharmaceutical scaffolds.
Is this compound used beyond tamoxifen synthesis?
Yes, it's a general-purpose alkylating building block applicable across various API classes requiring chloroethoxy or (after further reaction) aminoethoxyphenyl substituents.
What is the recommended storage condition?
Store in a tightly sealed container at room temperature, protected from moisture and light.

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