[1,1'-Biphenyl]-2,3'-diol

Base Information

• Chemical Name: [1,1'-Biphenyl]-2,3'-diol
• CAS No.: 31835-45-7
• Molecular Formula: C12H10 O2
• Molecular Weight: 186.21
• Hs Code.: 2907290090
• European Community (EC) Number: 250-829-9
• UNII: 7EL13090VE
• DSSTox Substance ID: DTXSID9067649
• Nikkaji Number: J278.197B
• Wikidata: Q27268160
• ChEMBL ID: CHEMBL3815107
• Mol file: 31835-45-7.mol

Synonyms:[1,1'-Biphenyl]-2,3'-diol;31835-45-7;3-(2-HYDROXYPHENYL)PHENOL;Diphenol;2,3'-Biphenyldiol;2-(3-hydroxyphenyl)phenol;2,3'-Dihydroxybiphenyl;ar,ar'-Biphenyldiol;2,3'-biphenol;(1,1'-Biphenyl)-2,3'-diol;UNII-7EL13090VE;(1,1'-Biphenyl)-ar,ar'-diol;7EL13090VE;EINECS 248-156-0;EINECS 250-829-9;Biphenyl-2,3'-diol;biphenyldiol;UNII-0YU5Z7G85W;0YU5Z7G85W;SCHEMBL2186104;2,5'-DIHYDROXYBIPHENYL;CHEMBL3815107;DTXSID9067649;MFCD00137785;BS-28237;LS-44343;CS-0209325;Q27268160

Chemical Property of [1,1'-Biphenyl]-2,3'-diol

Chemical Property:

• Boiling Point: 370.4°Cat760mmHg
• PKA: 9?+-.0.10(Predicted)
• Flash Point: 185°C
• PSA: 40.46000
• Density: 1.228g/cm³
• LogP: 2.76480
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 186.068079557
• Heavy Atom Count: 14
• Complexity: 181

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(=C1)C2=CC(=CC=C2)O)O

Technology Process of [1,1'-Biphenyl]-2,3'-diol

There total 4 articles about [1,1'-Biphenyl]-2,3'-diol 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: 93.0%

3-Iodophenol (626-02-8) + 2-hydroxyphenyl boronic acid (89466-08-0) → 1,1'-biphenyl-2,3'-diol (31835-45-7)

Guidance literature:

With palladium 10% on activated carbon; potassium carbonate; In water; at 80 ℃; for 2.5h; Inert atmosphere;

DOI:10.1021/jo500675a

Reference yield: 91.0%

2-Iodophenol (533-58-4) + 3-hydroxyphenylboronic acid (87199-18-6) → 1,1'-biphenyl-2,3'-diol (31835-45-7)

Guidance literature:

With palladium 10% on activated carbon; potassium carbonate; In water; at 80 ℃; for 2.5h; Inert atmosphere;

DOI:10.1021/jo500675a

Reference yield: 87.0%

2-hydroxybromobenzene (95-56-7) + 3-hydroxyphenylboronic acid (87199-18-6) → 1,1'-biphenyl-2,3'-diol (31835-45-7)

Guidance literature:

With palladium 10% on activated carbon; potassium hydroxide; at 150 ℃; for 0.5h; Microwave irradiation; Inert atmosphere;

DOI:10.1021/jo500675a

upstream raw materials:

2-Iodophenol

3-hydroxyphenylboronic acid

3-Iodophenol

2-hydroxyphenyl boronic acid

Refernces

Structure-Activity Relationship of Antiestrogens. Phenolic Analogues of 2,3-Diaryl-2H-1-benzopyrans

10.1021/jm00174a020

The research focuses on the structure-activity relationship of antiestrogens, specifically phenolic analogues of 2,3-diaryl-2H-1-benzopyrans (DABP). The purpose of the study was to synthesize and evaluate these compounds for their potential as antiestrogens, with the aim of understanding the molecular origins of their partial agonist-antagonist character. The conclusions drawn from the research indicated that the incorporation of hydroxyl groups at certain positions in the benzopyran structure significantly improved receptor affinity and antagonist activity without affecting estrogen agonist activity. Notably, the monophenol 19 and the diphenol 25 emerged as potent antiestrogens, exhibiting marked antiestrogenic activity and being more effective than tamoxifen, trioxifen, and LY-117018.

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