2-(3,5-Dimethoxyphenyl)phenol

Base Information

• Chemical Name: 2-(3,5-Dimethoxyphenyl)phenol
• CAS No.: 168301-25-5
• Molecular Formula: C14H14 O3
• Molecular Weight: 230.263
• DSSTox Substance ID: DTXSID60457632
• Nikkaji Number: J691.947B
• Wikidata: Q82280545
• Metabolomics Workbench ID: 121631
• ChEMBL ID: CHEMBL1079776
• Mol file: 168301-25-5.mol

Synonyms:2-(3,5-dimethoxyphenyl)phenol;168301-25-5;3',5'-Dimethoxy-[1,1'-biphenyl]-2-ol;Isoaucuparin;CHEMBL1079776;DTXSID60457632;MFCD18312921;AKOS017557175;3',5'-Dimethoxy[1,1'-biphenyl]-2-ol;EN300-1608376;Z1575342895

Chemical Property of 2-(3,5-Dimethoxyphenyl)phenol

Chemical Property:

• PSA: 38.69000
• LogP: 3.07640
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 230.094294304
• Heavy Atom Count: 17
• Complexity: 220

Purity/Quality:

2-(3,5-Dimethoxyphenyl)phenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC(=C1)C2=CC=CC=C2O)OC

Technology Process of 2-(3,5-Dimethoxyphenyl)phenol

There total 6 articles about 2-(3,5-Dimethoxyphenyl)phenol 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: 92.0%

6-diazo-2-cyclohexen-1-one (928642-45-9) + 1-iodo-3,5-dimethoxybenzene (25245-27-6) → 3',5'-dimethoxy[1,1'-biphenyl]-2-ol (168301-25-5)

Guidance literature:

With potassium phosphate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; at 50 ℃; for 5h; Solvent; Reagent/catalyst; Inert atmosphere;

DOI:10.1021/ol303484f

Reference yield: 70.0%

2-(benzyloxy)-3',5'-dimethoxy-1,1'-biphenyl → 3',5'-dimethoxy[1,1'-biphenyl]-2-ol (168301-25-5)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In ethanol; at 70 ℃;

DOI:10.1002/chem.201604313

Reference yield: 40.0%

1-(2-Iodo-phenoxymethyl)-3,5-dimethoxy-benzene → 3',5'-dimethoxy[1,1'-biphenyl]-2-ol (168301-25-5) + 7,9-dimethoxy-6H-benzo[c]chromene

Guidance literature:

With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride; In toluene; at 80 ℃;

DOI:10.1016/S0040-4039(00)02111-0

upstream raw materials:

methanol

(E)-4-(2-hydroxyphenyl)but-3-en-2-one

malonic acid dimethyl ester

6-diazo-2-cyclohexen-1-one

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