3-Bromo-6-hydroxy-2-methylbenzoic acid

Base Information

• Chemical Name: 3-Bromo-6-hydroxy-2-methylbenzoic acid
• CAS No.: 252955-18-3
• Molecular Formula: C₈H₇BrO₃
• Molecular Weight: 231.046
• European Community (EC) Number: 845-141-6
• Mol file: 252955-18-3.mol

Synonyms:252955-18-3;3-bromo-6-hydroxy-2-methylbenzoic acid;3-bromo-6-hydroxy-2-methyl-benzoic Acid;SCHEMBL147587;AJXOCFKDIBBTJK-UHFFFAOYSA-N;CKA95518;2-Hydroxy-5-bromo-6-methylbenzoic acid;3-bromo-6-hydroxy-2-methyl-benzoicAcid;CS-0105595;D76566;EN300-338288

Chemical Property of 3-Bromo-6-hydroxy-2-methylbenzoic acid

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 229.95786
• Heavy Atom Count: 12
• Complexity: 183

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1C(=O)O)O)Br

Technology Process of 3-Bromo-6-hydroxy-2-methylbenzoic acid

There total 2 articles about 3-Bromo-6-hydroxy-2-methylbenzoic acid 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: 82.0%

2-hydroxy-6-methylbenzoic acid (567-61-3) → 3-bromo-6-hydroxy-2-methylbenzoic acid (252955-18-3)

Guidance literature:

With N-Bromosuccinimide; acetic acid; In water; acetonitrile; at 0 - 20 ℃; for 3.5h;

Reference yield:

→ 3-bromo-6-hydroxy-2-methylbenzoic acid (252955-18-3)

Guidance literature:

Reference yield: 68.0%

3-bromo-6-hydroxy-2-methylbenzoic acid (252955-18-3) + aniline (62-53-3) → 3-bromo-6-hydroxy-2-methyl-N-phenylbenzamide (1231891-36-3)

Guidance literature:

3-bromo-6-hydroxy-2-methylbenzoic acid; With 1,2,3-Benzotriazole; thionyl chloride; In tetrahydrofuran; dichloromethane; at 20 ℃; for 2h;

aniline; at 150 ℃; for 0.166667h; Irradiation; Sealed tube;

upstream raw materials:

2-hydroxy-6-methylbenzoic acid

Downstream raw materials:

3-bromo-6-hydroxy-2-methyl-N-phenylbenzamide