1,2,3-Trichloro-5-(chloromethyl)benzene

Base Information

• Chemical Name: 1,2,3-Trichloro-5-(chloromethyl)benzene
• CAS No.: 79185-27-6
• Molecular Formula: C7H4Cl4
• Molecular Weight: 229.921
• DSSTox Substance ID: DTXSID10513419
• Wikidata: Q82373228
• Mol file: 79185-27-6.mol

Synonyms:1,2,3-Trichloro-5-(chloromethyl)benzene;79185-27-6;3,4,5-trichlorobenzyl chloride;SCHEMBL7273122;DTXSID10513419;MFCD18400125

Chemical Property of 1,2,3-Trichloro-5-(chloromethyl)benzene

Chemical Property:

• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 229.903761
• Heavy Atom Count: 11
• Complexity: 116

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1Cl)Cl)Cl)CCl

Technology Process of 1,2,3-Trichloro-5-(chloromethyl)benzene

There total 3 articles about 1,2,3-Trichloro-5-(chloromethyl)benzene 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:

3,4,5-trichloro-toluene (21472-86-6) → 3,4,5-trichlorobenzyl chloride (79185-27-6)

Guidance literature:

With sulfuryl dichloride; dibenzoyl peroxide;

DOI:10.1111/j.2042-7158.1958.tb10394.x

Reference yield:

3,4,5-trichloro-benzyl alcohol (7520-67-4) → 3,4,5-trichlorobenzyl chloride (79185-27-6)

Guidance literature:

With thionyl chloride;

Reference yield:

3,4,5-trichlorobenzoic acid (51-39-8) → 3,4,5-trichlorobenzyl chloride (79185-27-6)

Guidance literature:

Multi-step reaction with 2 steps

1: LiAlH₄; diethyl ether

2: thionyl chloride

With lithium aluminium tetrahydride; thionyl chloride; diethyl ether;

upstream raw materials:

3,4,5-trichloro-benzyl alcohol

3,4,5-trichloro-toluene

3,4,5-trichlorobenzoic acid

Downstream raw materials:

3,4,5-trichloro-benzyl alcohol

2-(3,4,5-Trichloro-benzyl)-isothiourea; hydrochloride

(4-Fluoro-phenyl)-(3,4,5-trichloro-benzyl)-amine

N-(4-Fluoro-phenyl)-N-(3,4,5-trichloro-benzyl)-benzenesulfonamide