1,2,4-Trichloro-5-(chloromethyl)benzene

Base Information

• Chemical Name: 1,2,4-Trichloro-5-(chloromethyl)benzene
• CAS No.: 3955-26-8
• Molecular Formula: C7H4 Cl4
• Molecular Weight: 229.921
• Hs Code.: 2903999090
• European Community (EC) Number: 223-548-4
• NSC Number: 141491
• UNII: UX2FDH9GLC
• DSSTox Substance ID: DTXSID4063242
• Nikkaji Number: J217.785D
• Wikidata: Q81990597
• Mol file: 3955-26-8.mol

Synonyms:1,2,4-Trichloro-5-(chloromethyl)benzene;3955-26-8;Benzene, 1,2,4-trichloro-5-(chloromethyl)-;UX2FDH9GLC;EINECS 223-548-4;NSC-141491;2,4,5-Trichlorobenzyl chloride;NSC141491;UNII-UX2FDH9GLC;2,5-Trichlorobenzyl chloride;DTXSID4063242;SCHEMBL11779597;NSC 141491;Benzene,2,4-trichloro-5-(chloromethyl)-;1,2,4-Trichloro-5-(chloromethyl)benzene #;EN300-6777852

Chemical Property of 1,2,4-Trichloro-5-(chloromethyl)benzene

Chemical Property:

• Vapor Pressure: 0.00983mmHg at 25°C
• Melting Point: 54.38°C (estimate)
• Refractive Index: 1.5149 (estimate)
• Boiling Point: 273°Cat760mmHg
• Flash Point: 127.8°C
• PSA: 0.00000
• Density: 1.502g/cm³
• LogP: 4.38560
• 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: 128

Purity/Quality:

98%, ^*data from raw suppliers

1,2,4-trichloro-5-(chloromethyl)benzene 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1,2,4-Trichloro-5-(chloromethyl)benzene

There total 4 articles about 1,2,4-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:

2,4,5-trichlorotoluene (6639-30-1) → 1,2,4-trichloro-5-chloromethyl-benzene (3955-26-8)

Guidance literature:

With sulfuryl dichloride; dibenzoyl peroxide;

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

Reference yield:

bis(2-chloromethyl)ether (542-88-1) + 1,2,4-Trichlorobenzene (120-82-1,63697-18-7) → 1,2,4-trichloro-5-chloromethyl-benzene (3955-26-8)

Guidance literature:

With sulfuric acid; at 0 ℃;

Reference yield:

chloromethyl methyl ether (107-30-2) + 1,2,4-Trichlorobenzene (120-82-1,63697-18-7) → 1,2,4-trichloro-5-chloromethyl-benzene (3955-26-8)

Guidance literature:

With sulfuric acid;

upstream raw materials:

2,4,5-trichlorotoluene

bis(2-chloromethyl)ether

1,2,4-Trichlorobenzene

chloromethyl methyl ether

Downstream raw materials:

(4-chloro-phenyl)-(2,4,5-trichloro-benzyl)-sulfide

phenyl-(2,4,5-trichloro-benzyl)-sulfide

p-tolyl-(2,4,5-trichloro-benzyl)-sulfide

(2,4,5-trichlorophenyl)methanol

Refernces

• 1、 CARTER,CHARLTON,FENTON,HOUSLEY,LESSEL. "The preparation and the antibacterial and antifungal properties of some". . p. 149-157T; discussion 157-159T. Retrieved 2007/10/05.