2-Bromo-6-(hydroxymethyl)-4-methylphenol

Base Information

• Chemical Name: 2-Bromo-6-(hydroxymethyl)-4-methylphenol
• CAS No.: 43135-49-5
• Molecular Formula: C8H9BrO2
• Molecular Weight: 217.062
• European Community (EC) Number: 684-319-6
• DSSTox Substance ID: DTXSID20402042
• Nikkaji Number: J803.881C
• Wikidata: Q82205393
• Mol file: 43135-49-5.mol

Synonyms:43135-49-5;BENZENEMETHANOL,3-BROMO-2-HYDROXY-5-METHYL-;2-bromo-6-(hydroxymethyl)-4-methylphenol;SCHEMBL9560149;DTXSID20402042;AKOS022652351;2-Bromo-6-hydroxymethyl-4-methylphenol;3-Brom-2-hydroxy-5-methylbenzylalkohol

Chemical Property of 2-Bromo-6-(hydroxymethyl)-4-methylphenol

Chemical Property:

• PSA: 40.46000
• LogP: 1.95540
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 215.97859
• Heavy Atom Count: 11
• Complexity: 129

Purity/Quality:

95% ^*data from raw suppliers

BENZENEMETHANOL,3-BROMO-2-HYDROXY-5-METHYL- 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C(=C1)Br)O)CO

Technology Process of 2-Bromo-6-(hydroxymethyl)-4-methylphenol

There total 2 articles about 2-Bromo-6-(hydroxymethyl)-4-methylphenol 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: 91.0%

methyl 3-bromo-2-hydroxy-5-methylbenzoate (17746-77-9) → 2-bromo-6-(hydroxymethyl)-4-methyl-phenol (43135-49-5)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; Inert atmosphere; Reflux;

DOI:10.1021/jm800853p

Reference yield: 60.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 2-bromo-p-cresol (6627-55-0) → 2-bromo-6-(hydroxymethyl)-4-methyl-phenol (43135-49-5)

Guidance literature:

With potassium hydroxide; In water; isopropyl alcohol; at 60 - 70 ℃; for 6h;

DOI:10.1021/ja00329a058

Reference yield: 93.0%

2-bromo-6-(hydroxymethyl)-4-methyl-phenol (43135-49-5) + dimethyl sulfate (77-78-1) → 1-Bromo-2-methoxy-3-(methoxymethyl)-5-methylbenzene (120461-58-7)

Guidance literature:

With sodium hydride; In tetrahydrofuran;

DOI:10.1021/jo00302a028

upstream raw materials:

formaldehyd

2-bromo-p-cresol

methyl 3-bromo-2-hydroxy-5-methylbenzoate

Downstream raw materials:

2-hydroxymethyl-4-methylphenol

2-bromo-6-bromomethyl-4-methyl-phenol

bis-(3-bromo-2-hydroxy-5-methyl-benzyl)-ether

2-Bromo-6-(ethoxymethyl)-4-methylethoxybenzene

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