4-Biphenylhydracrylic acid, 4'-fluoro-beta-(m-tolyl)-, (+)-

Base Information

• Chemical Name: 4-Biphenylhydracrylic acid, 4'-fluoro-beta-(m-tolyl)-, (+)-
• CAS No.: 95711-58-3
• Molecular Formula: C₂₂H₁₉FO₃
• Molecular Weight: 350.389
• DSSTox Substance ID: DTXSID20914852
• Mol file: 95711-58-3.mol

Synonyms:95711-57-2;4-Biphenylhydracrylic acid, 4'-fluoro-beta-(m-tolyl)-, (+)-;4-Biphenylhydracrylic acid, 4'-fluoro-beta-(m-tolyl)-, (-)-;(+)-4'-Fluoro-beta-(m-tolyl)-4-biphenylhydracrylic acid;(-)-4'-Fluoro-beta-(m-tolyl)-4-biphenylhydracrylic acid;(1,1'-Biphenyl)-4-propanoic acid, 4'-fluoro-beta-hydroxy-beta-(3-methylphenyl)-, (+)-;(1,1'-Biphenyl)-4-propanoic acid, 4'-fluoro-beta-hydroxy-beta-(3-methylphenyl)-, (-)-;95711-58-3;DTXSID20914852;4-Biphenylhydracrylic acid,4'-fluoro-beta-(m-tolyl)-,(+)-;3-(4'-Fluoro[1,1'-biphenyl]-4-yl)-3-hydroxy-3-(3-methylphenyl)propanoic acid

Chemical Property of 4-Biphenylhydracrylic acid, 4'-fluoro-beta-(m-tolyl)-, (+)-

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 350.13182263
• Heavy Atom Count: 26
• Complexity: 466

Purity/Quality:

99%min ^*data from raw suppliers

4-BIPHENYLHYDRACRYLIC ACID, 4'-FLUORO-BETA-(M-TOLYL)-, (-)- 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)C(CC(=O)O)(C2=CC=C(C=C2)C3=CC=C(C=C3)F)O

Technology Process of 4-Biphenylhydracrylic acid, 4'-fluoro-beta-(m-tolyl)-, (+)-

There total 4 articles about 4-Biphenylhydracrylic acid, 4'-fluoro-beta-(m-tolyl)-, (+)- 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-(4'-Fluoro-biphenyl-4-yl)-3-hydroxy-3-m-tolyl-propionic acid ethyl ester (95711-78-7) → 3-(4'-Fluoro-biphenyl-4-yl)-3-hydroxy-3-m-tolyl-propionic acid (95711-57-2,95711-58-3)

Guidance literature:

With sodium hydroxide; In ethanol;

DOI:10.1002/ardp.19853180211

Reference yield:

4-fluoro-biphenyl (324-74-3) → 3-(4'-Fluoro-biphenyl-4-yl)-3-hydroxy-3-m-tolyl-propionic acid (95711-57-2,95711-58-3)

Guidance literature:

Multi-step reaction with 3 steps

1: 80 percent / AlCl₃ / CS₂ / Heating

2: 90 percent

3: 100 percent / 2 N NaOH / ethanol

With sodium hydroxide; aluminium trichloride; In carbon disulfide; ethanol;

DOI:10.1002/ardp.19853180211

Reference yield:

(4'-Fluoro-biphenyl-4-yl)-m-tolyl-methanone (95711-73-2) → 3-(4'-Fluoro-biphenyl-4-yl)-3-hydroxy-3-m-tolyl-propionic acid (95711-57-2,95711-58-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 90 percent

2: 100 percent / 2 N NaOH / ethanol

With sodium hydroxide; In ethanol;

DOI:10.1002/ardp.19853180211

upstream raw materials:

3-(4'-Fluoro-biphenyl-4-yl)-3-hydroxy-3-m-tolyl-propionic acid ethyl ester

4-fluoro-biphenyl

(4'-Fluoro-biphenyl-4-yl)-m-tolyl-methanone

3-Methylbenzoyl chloride

Refernces