Benzoic acid, 2,6-bis(bromomethyl)-, methyl ester

Base Information

Chemical Name:Benzoic acid, 2,6-bis(bromomethyl)-, methyl ester
CAS No.:56263-51-5
Molecular Formula:C10H10Br2O2
Molecular Weight:321.996
Hs Code.:
DSSTox Substance ID:DTXSID40480968
Wikidata:Q82316139

Synonyms:56263-51-5;Benzoic acid, 2,6-bis(bromomethyl)-, methyl ester;SCHEMBL9544732;DTXSID40480968

Suppliers and Price of Benzoic acid, 2,6-bis(bromomethyl)-, methyl ester

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Benzoic acid, 2,6-bis(bromomethyl)-, methyl ester

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:321.90271
Heavy Atom Count:14
Complexity:185

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=C(C=CC=C1CBr)CBr

Technology Process of Benzoic acid, 2,6-bis(bromomethyl)-, methyl ester

There total 4 articles about Benzoic acid, 2,6-bis(bromomethyl)-, methyl ester 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: 81.0%

: 14920-81-1
methyl 2,6-dimethylbenzoate

: 56263-51-5
methyl 2,6-di(bromomethyl)benzoate

Guidance literature:: With N-Bromosuccinimide; dibenzoyl peroxide; In tetrachloromethane; at 80 ℃; for 8h; Inert atmosphere;
DOI:10.1021/jacs.6b04339

Reference yield:

: 14920-81-1
methyl 2,6-dimethylbenzoate

: 56263-51-5
methyl 2,6-di(bromomethyl)benzoate

: 56427-77-1
2-bromomethyl-6-methyl-benzoic acid methyl ester

Guidance literature:: With N-Bromosuccinimide; In tetrachloromethane; for 3h; Title compound not separated from byproducts; Heating; Irradiation;
DOI:10.1007/BF00807401

Reference yield:

: 21900-37-8
2,6-dimethylbenzoyl chloride

: 56263-51-5
methyl 2,6-di(bromomethyl)benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: Py

2: NBS, AIBN, (PhCO)2O₂ / Irradiation

With pyridine; N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); dibenzoyl peroxide;