3,5-Dimethoxy-4-methylphenol

Base Information

• Chemical Name: 3,5-Dimethoxy-4-methylphenol
• CAS No.: 22080-97-3
• Molecular Formula: C9H12O3
• Molecular Weight: 168.192
• DSSTox Substance ID: DTXSID401309627
• Nikkaji Number: J733.660H
• Mol file: 22080-97-3.mol

Synonyms:3,5-dimethoxy-4-methylphenol;22080-97-3;SCHEMBL320899;4-Methyl-3,5-dimethoxyphenol;4-hydroxy-2,6-dimethoxytoluene;UXGHDWLJFHAOMB-UHFFFAOYSA-N;DTXSID401309627;Phenol, 3,5-dimethoxy-4-methyl-;FT-0707118;EN300-1867037

Chemical Property of 3,5-Dimethoxy-4-methylphenol

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 168.078644241
• Heavy Atom Count: 12
• Complexity: 124

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1OC)O)OC

Technology Process of 3,5-Dimethoxy-4-methylphenol

There total 15 articles about 3,5-Dimethoxy-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: 100.0%

(3,5-dimethoxy-4-methylphenoxy)triisopropylsilane (831171-37-0) → 3,5-dimethoxy-4-methylphenol (22080-97-3)

Guidance literature:

With hydrogenchloride; In ethanol; water; at 23 ℃; for 20h;

DOI:10.1002/anie.200461294

Reference yield: 79.0%

syringaldehyde (22080-96-2) → 3,5-dimethoxy-4-methylphenol (22080-97-3)

Guidance literature:

With hydrogenchloride; amalgamated zinc; In acetic acid; for 2h; Heating;

Reference yield: 64.0%

2,4,6-trimethoxytoluene (14107-97-2) → 2-hydroxy-4,6-dimethoxytoluene (39828-36-9) + 3,5-dimethoxy-4-methylphenol (22080-97-3)

Guidance literature:

With orcinol; Acetobacterium dehalogenans veratrol-O-demethylase; Desulfitobacterium hafniense methyltransferase dhaf4611; In aq. buffer; at 35 ℃; for 24h; pH=6.5; regioselective reaction; Inert atmosphere; Enzymatic reaction;

DOI:10.1021/acscatal.0c02790

upstream raw materials:

1-benzyloxy-4-formyl-3,5-dimethoxybenzene

syringaldehyde

acetic acid

(3,5-dimethoxy-4-methylphenoxy)triisopropylsilane

Downstream raw materials:

6-hydroxy-2,4-dimethoxy-3-methyl-benzaldehyde

4-acetoxy-2,6-dimethoxy-toluene

Strobochrysin dimethylether

(3,5-dimethoxy-4-methyl-phenoxy)-acetone