3,5-dichloro-2-methoxy-benzoyl Chloride

Base Information

• Chemical Name: 3,5-dichloro-2-methoxy-benzoyl Chloride
• CAS No.: 5213-08-1
• Molecular Formula: C8H5Cl3O2
• Molecular Weight: 239.485
• DSSTox Substance ID: DTXSID30453929
• Wikidata: Q82275225
• Mol file: 5213-08-1.mol

Synonyms:3,5-dichloro-2-methoxy-benzoyl Chloride;3,5-dichloro-2-methoxybenzoyl chloride;5213-08-1;SCHEMBL10864147;DTXSID30453929;AKOS000296157;BB 0245721

Chemical Property of 3,5-dichloro-2-methoxy-benzoyl Chloride

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 237.935512
• Heavy Atom Count: 13
• Complexity: 198

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1Cl)Cl)C(=O)Cl

Technology Process of 3,5-dichloro-2-methoxy-benzoyl Chloride

There total 4 articles about 3,5-dichloro-2-methoxy-benzoyl 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:

3,5-dichloro-2-methoxybenzoic acid (22775-37-7) → 3,5-dichloro-2-methoxybenzoyl chloride (5213-08-1)

Guidance literature:

With oxalyl dichloride; N,N-dimethyl-formamide; In tetrahydrofuran;

DOI:10.1021/jo00302a011

Reference yield:

3,5-dichlorosalicylic acid (320-72-9) → 3,5-dichloro-2-methoxybenzoyl chloride (5213-08-1)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium hydroxide / H₂O / 4 h / 95 - 100 °C

2: thionyl chloride / dimethylformamide / CHCl₃ / Heating

With sodium hydroxide; thionyl chloride; N,N-dimethyl-formamide; In chloroform; water;

DOI:10.1023/B:RUGC.0000039088.87053.eb

Reference yield:

methyl 3,5-dichloro-2-methoxybenzoate (64122-23-2) → 3,5-dichloro-2-methoxybenzoyl chloride (5213-08-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 72 percent / KOH / methanol; H₂O / 4 h / Heating

2: thionyl chloride / 1 h / Heating

With potassium hydroxide; thionyl chloride; In methanol; water;

upstream raw materials:

3,5-dichloro-2-methoxybenzoic acid

3,5-dichlorosalicylic acid

methyl 3,5-dichloro-2-methoxybenzoate

Downstream raw materials:

1-(3,5-Dichlor-2-methoxyphenyl)-3-(1,3-dioxan-2-yl)-1-propanon

ethyl 4-(3,5-dichloro-2-hydroxybenzoyl)pyrrole-2-carboxylate

2,4-dichloro-9H-xanthen-9-one

3,5-dichloro-N-(3-chloro-4-(naphthalen-2-yloxy)phenyl)-2-methoxybenzamide

Refernces

• 1、 Liu, Yaya,Donner, Pamela L.,Pratt, John K.,Jiang, Wen W.,Ng, Teresa,Gracias, Vijaya,Baumeister, Steve,Wiedeman, Paul E.,Traphagen, Linda,Warrior, Usha,Maring, Clarence,Kati, Warren M.,Djuric, Stevan W.,Molla, Akhteruzzaman. "Identification of halosalicylamide derivatives as a novel class of allosteric inhibitors of HCV NS5B polymerase". scheme or table. p. 3173 - 3177. Retrieved 2009/04/11.
• 2、 Pilyugin,Sapozhnikov,Chikisheva,Kiseleva,Vorob'eva,Klimakova,Sapozhnikova,Kuznetsova. "Synthesis of bis(arylcarbonylamino-1H-benzimidazol-5-yl) ethers". . p. 1327 - 1330. Retrieved 2008/02/04.