5-Methyl-2-(phenylmethoxy)-1,3-benzenedicarboxylic acid

Base Information

Chemical Name:5-Methyl-2-(phenylmethoxy)-1,3-benzenedicarboxylic acid
CAS No.:84379-35-1
Molecular Formula:C₁₆H₁₄O₅
Molecular Weight:286.284
Hs Code.:
DSSTox Substance ID:DTXSID501204488

Synonyms:5-Methyl-2-(phenylmethoxy)-1,3-benzenedicarboxylic acid;DTXSID501204488;84379-35-1

Suppliers and Price of 5-Methyl-2-(phenylmethoxy)-1,3-benzenedicarboxylic acid

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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 5-Methyl-2-(phenylmethoxy)-1,3-benzenedicarboxylic acid

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:286.08412354
Heavy Atom Count:21
Complexity:351

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=C(C(=C1)C(=O)O)OCC2=CC=CC=C2)C(=O)O

Technology Process of 5-Methyl-2-(phenylmethoxy)-1,3-benzenedicarboxylic acid

There total 4 articles about 5-Methyl-2-(phenylmethoxy)-1,3-benzenedicarboxylic 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: 72.0%

: 124-38-9,18923-20-1
carbon dioxide

: 84379-34-0
1-(phenylmethoxy)-2,6-dibromo-4-methylbenzene

: 84379-35-1
1-(phenylmethoxy)-2,6-dicarboxy-4-methylbenzene

Guidance literature:: With sec.-butyllithium; In tetrahydrofuran;
DOI:10.1039/c39820001219

Reference yield:

: 2432-14-6
3,5-dibromo-4-hydroxytoluene

: 84379-35-1
1-(phenylmethoxy)-2,6-dicarboxy-4-methylbenzene

Guidance literature:: Multi-step reaction with 2 steps

1: 65 percent / K₂CO₃, KI / acetone

2: 72 percent / s-BuLi / tetrahydrofuran

With sec.-butyllithium; potassium carbonate; potassium iodide; In tetrahydrofuran; acetone;
DOI:10.1039/c39820001219

Reference yield:

: 100-39-0
benzyl bromide

: 84379-35-1
1-(phenylmethoxy)-2,6-dicarboxy-4-methylbenzene

Guidance literature:: Multi-step reaction with 2 steps

1: 65 percent / K₂CO₃ / acetone / 24 h

2: 1.) 1.5 M sec-butyllithium / 1.) THF, -78 deg C, 12 min

With sec.-butyllithium; potassium carbonate; In acetone;
DOI:10.1021/ja00335a049