2-Chloro-3-methylbenzoyl chloride

Base Information

• Chemical Name: 2-Chloro-3-methylbenzoyl chloride
• CAS No.: 21900-56-1
• Molecular Formula: C8H6Cl2O
• Molecular Weight: 189.041
• European Community (EC) Number: 848-525-1
• DSSTox Substance ID: DTXSID10598428
• Wikidata: Q82494186
• Mol file: 21900-56-1.mol

Synonyms:2-Chloro-3-methylbenzoyl chloride;21900-56-1;Benzoyl chloride, 2-chloro-3-methyl-;2-chloro-m-toluoyl chloride;o-chloro-methylbenzoyl chloride;SCHEMBL2963108;2-Chloro-3-methylbenzoylchloride;DTXSID10598428;FUUCTBPASNZPKE-UHFFFAOYSA-N;AKOS017516775;DA-08089;EN300-1459145

Chemical Property of 2-Chloro-3-methylbenzoyl chloride

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 187.9795702
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C(=O)Cl)Cl

Technology Process of 2-Chloro-3-methylbenzoyl chloride

There total 2 articles about 2-Chloro-3-methylbenzoyl chloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

2-chloro-3-methylbenzoic acid (15068-35-6) → 2-chloro-3-methylbenzoyl chloride (21900-56-1)

Guidance literature:

With thionyl chloride;

Reference yield:

oxalyl dichloride (79-37-8) + 2-chloro-3-methylbenzoic acid (15068-35-6) → 2-chloro-3-methylbenzoyl chloride (21900-56-1)

Guidance literature:

In ethyl acetate; N,N-dimethyl-formamide;

Reference yield: 97.0%

2-chloro-3-methylbenzoyl chloride (21900-56-1) → 3-(4-methoxybenzoyl)-2-chlorotoluene

Guidance literature:

In methoxybenzene;

upstream raw materials:

2-chloro-3-methylbenzoic acid

oxalyl dichloride

Downstream raw materials:

3-(4-chlorobenzoyl)-4-chlorotoluene

3-(4-chlorobenzoyl)-4-chlorobenzyl bromide

3-(4-chlorobenzoyl)-4-chlorobenzyl azide

5-amino-1-(3-[4-chlorobenzoyl]-4-chlorobenzyl)-1,2,3-triazole-4-carboxamide