(3-Methylphenyl) 2-hydroxybenzoate

Base Information

• Chemical Name: (3-Methylphenyl) 2-hydroxybenzoate
• CAS No.: 620-46-2
• Molecular Formula: C14H12O3
• Molecular Weight: 228.247
• DSSTox Substance ID: DTXSID00450127
• Nikkaji Number: J136.476F
• Wikidata: Q82269710
• Mol file: 620-46-2.mol

Synonyms:620-46-2;(3-methylphenyl) 2-hydroxybenzoate;Salicylic acid m-tolyl ester;Salicylic acid, m-tolyl ester;SCHEMBL8205625;DTXSID00450127;3-METHYLPHENYL 2-HYDROXYBENZOATE

Chemical Property of (3-Methylphenyl) 2-hydroxybenzoate

Chemical Property:

• PSA: 46.53000
• LogP: 2.91980
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 228.078644241
• Heavy Atom Count: 17
• Complexity: 264

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)OC(=O)C2=CC=CC=C2O

Technology Process of (3-Methylphenyl) 2-hydroxybenzoate

There total 8 articles about (3-Methylphenyl) 2-hydroxybenzoate 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: 95.0%

m-tolyl-2-methoxybenzoate (108478-25-7) → 3'-methylphenyl salicylate (620-46-2)

Guidance literature:

With beryllium(II) chloride; In toluene; for 4h;

DOI:10.1016/0040-4020(96)00815-0

Reference yield: 91.0%

2-(trifluoromethyl)phenol (444-30-4) + 3-methyl-phenol (108-39-4) → 3'-methylphenyl salicylate (620-46-2)

Guidance literature:

With water; potassium carbonate; In toluene; at 120 ℃; for 12h;

DOI:10.1016/j.tetlet.2021.153592

Reference yield: 90.0%

2-m-tolyloxy-benzoic acid (6338-04-1) → 3'-methylphenyl salicylate (620-46-2)

Guidance literature:

With dipotassium hydrogenphosphate; Lumogen F Orange 240; In acetonitrile; at 40 ℃; for 26h; Irradiation; Inert atmosphere;

DOI:10.1002/anie.201706597

upstream raw materials:

3-methyl-phenol

salicylic acid

m-tolyl-2-methoxybenzoate

2-m-tolyloxy-benzoic acid

Downstream raw materials:

2-Allyloxy-benzoic acid m-tolyl ester

2-Carbamoyloxy-benzoic acid m-tolyl ester

Refernces

• 1、 Tripathy, Alisha Rani,Yatham, Veera Reddy,Yedase, Girish Suresh. "Cerium photocatalyzed radical smiles rearrangement of 2-aryloxybenzoic acids". . p. 25207 - 25210. Retrieved 2021/08/05.
• 2、 Wang, Shao-Feng,Cao, Xiao-Ping,Li, Yang. "Efficient Aryl Migration from an Aryl Ether to a Carboxylic Acid Group To Form an Ester by Visible-Light Photoredox Catalysis". . p. 13809 - 13813. Retrieved 2017/10/24.