3,3',4,4'-Biphenyltetrol

Base Information

• Chemical Name: 3,3',4,4'-Biphenyltetrol
• CAS No.: 3598-30-9
• Molecular Formula: C12H10O4
• Molecular Weight: 218.209
• NSC Number: 133369
• DSSTox Substance ID: DTXSID90189535
• Nikkaji Number: J689.424K
• Wikidata: Q83061655
• Pharos Ligand ID: A7BHGX8MWHC5
• ChEMBL ID: CHEMBL2337291
• Mol file: 3598-30-9.mol

Synonyms:3598-30-9;3,3',4,4'-Biphenyltetrol;[1,1'-Biphenyl]-3,3',4,4'-tetraol;4-(3,4-dihydroxyphenyl)benzene-1,2-diol;(1,1'-Biphenyl)-3,3',4,4'-tetrol;[1,1'-Biphenyl]-3,3',4,4'-tetrol;CHEMBL2337291;3,3',4,4'-Tetrahydroxydiphenyl;NSC133369;3,3',4,4'-TETRAHYDROXYBIPHENYL;3,4,3',4'-Tetrahydroxy-1,1'-biphenyl;3,4,4'-Biphenyltetrol;SCHEMBL338028;DTXSID90189535;MZEFNGQKJROKHS-UHFFFAOYSA-N;BDBM50490732;NSC 133369;NSC-133369;1,1'-Biphenyl-3,3',4,4'-tetrol;BS-51366;F77156

Chemical Property of 3,3',4,4'-Biphenyltetrol

Chemical Property:

• Boiling Point: 480.1°Cat760mmHg
• Flash Point: 243.4°C
• Density: 1.47g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 218.05790880
• Heavy Atom Count: 16
• Complexity: 209

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C2=CC(=C(C=C2)O)O)O)O

Technology Process of 3,3',4,4'-Biphenyltetrol

There total 11 articles about 3,3',4,4'-Biphenyltetrol 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: 80.0%

3,3',4,4'-tetramethoxylbiphenyl (2026-27-9) → 3,4,3′,4′-tetrahydroxy-1,1′-biphenyl (3598-30-9)

Guidance literature:

With boron tribromide; In dichloromethane; for 1h;

DOI:10.1039/DT9940000799

Reference yield: 70.0%

2,2'-dibromo-4,4',5,5'-tetramethoxybiphenyl (62012-50-4) → 3,4,3′,4′-tetrahydroxy-1,1′-biphenyl (3598-30-9)

Guidance literature:

With trimethylsilyl iodide; In dichloromethane; at 20 ℃; for 12h; Inert atmosphere;

DOI:10.1016/j.ejmech.2016.12.028

Reference yield: 51.0%

4,4'-bicyclohexanone (23391-99-3) → 3,4,3′,4′-tetrahydroxy-1,1′-biphenyl (3598-30-9)

Guidance literature:

With iodine; oxygen; dimethyl sulfoxide; at 80 ℃; for 12h;

DOI:10.1021/jacs.6b07269

upstream raw materials:

3,3',4,4'-tetramethoxylbiphenyl

benzene-1,2-diol

water

4-Bromoveratrole

Downstream raw materials:

(3,4,5-tris(2-(2-methoxyethoxy)ethoxy)phenyl)methanol

3,4,5-tris(2-(2-methoxyethoxy)ethoxy)benzyl chloride

3,4,3',4'-Tetrabenzyloxybiphenyl

Refernces

• 1、 Zhao, Kai-Chun,Du, Jun-Qi,Wang, Hai-Feng,Zhao, Ke-Qing,Hu, Ping,Wang, Bi-Qin,Monobe, Hirosato,Heinrich, Beno?t,Donnio, Bertrand. "Board-like Fused-Thiophene Liquid Crystals and their Benzene Analogs: Facile Synthesis, Self-Assembly, p-Type Semiconductivity, and Photoluminescence". . p. 462 - 470. Retrieved 2019.
• 2、 Stevens, Craig B.,Hanna Jr., James M.,Lammi, Robin K.. "Synthesis of tetrahydroxybiphenyls and tetrahydroxyterphenyls and their evaluation as amyloid-β aggregation inhibitors". . p. 1703 - 1706. Retrieved 2013.
• 3、 -. "COMPOSITION". Paragraph 16. . Retrieved 2016/12/22.