2-(2-Methoxyphenyl)phenol

Base Information

• Chemical Name: 2-(2-Methoxyphenyl)phenol
• CAS No.: 3594-88-5
• Molecular Formula: C13H12O2
• Molecular Weight: 200.237
• ChEMBL ID: CHEMBL3814579
• DSSTox Substance ID: DTXSID20467712
• Nikkaji Number: J596.130K
• Wikidata: Q82294768
• Mol file: 3594-88-5.mol

Synonyms:2-(2-methoxyphenyl)phenol;3594-88-5;2'-Methoxy[1,1'-biphenyl]-2-ol;[1,1'-Biphenyl]ol, methoxy-;SCHEMBL4398788;CHEMBL3814579;DTXSID20467712;MFCD06802848;AKOS004116645;BB 0223998

Chemical Property of 2-(2-Methoxyphenyl)phenol

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 200.083729621
• Heavy Atom Count: 15
• Complexity: 193

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1C2=CC=CC=C2O

Technology Process of 2-(2-Methoxyphenyl)phenol

There total 4 articles about 2-(2-Methoxyphenyl)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: 90.0%

2-hydroxybromobenzene (95-56-7) + 2-Methoxyphenylboronic acid (5720-06-9) → 2-(2-methoxyphenyl)phenol (3594-88-5)

Guidance literature:

With palladium 10% on activated carbon; tetra-n-butylammoniumfluoride trihydrate; at 150 ℃; for 0.5h; Reagent/catalyst; Microwave irradiation; Inert atmosphere;

DOI:10.1021/jo500675a

Reference yield: 19.2%

methoxybenzene (100-66-3) + N-phenoxy(4-methoxypyridinium) tetrafluoroborate → 2-(4-methoxyphenyl)phenol (21849-91-2) + 2-(2-methoxyphenyl)phenol (3594-88-5) + 4'-methoxy-1,1'-biphenyl-4-ol (16881-71-3) + 2'-methoxy-1,1'-biphenyl-4-ol (65109-82-2)

Guidance literature:

at 180 - 190 ℃; for 8h;

DOI:10.1021/ja00405a043

Reference yield:

N-(phenoxy)-4-methylbenzenesulfonamide (65109-75-3) + methoxybenzene (100-66-3) → 2-(4-methoxyphenyl)phenol (21849-91-2) + 2-(2-methoxyphenyl)phenol (3594-88-5) + 4'-methoxy-1,1'-biphenyl-4-ol (16881-71-3) + 2'-methoxy-1,1'-biphenyl-4-ol (65109-82-2)

Guidance literature:

With trifluorormethanesulfonic acid; trifluoroacetic acid; at 0 ℃; for 1h;

DOI:10.1021/ja00387a040

upstream raw materials:

N-(phenoxy)-4-methylbenzenesulfonamide

methoxybenzene

2-hydroxybromobenzene

2-Methoxyphenylboronic acid

Downstream raw materials:

3-bromo-2'-methoxybiphenyl-2-ol

3-bromo-2',2'-dimethoxybiphenyl

3-(2,2'-dimethoxybiphenyl)-3-carbonyl-1,3-thiazolidine-2-thione

C₃₇H₄₃N₃O₆

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