beta-Hydroxy-(1,1'-biphenyl)-4-propanoic acid

Base Information

• Chemical Name: beta-Hydroxy-(1,1'-biphenyl)-4-propanoic acid
• CAS No.: 71315-37-2
• Molecular Formula: C₁₅H₁₄O₃
• Molecular Weight: 242.274
• DSSTox Substance ID: DTXSID70991633
• Mol file: 71315-37-2.mol

Synonyms:71315-37-2;beta-Hydroxy-(1,1'-biphenyl)-4-propanoic acid;3-hydroxy-3-(4-phenylphenyl)propanoic acid;(1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-;DTXSID70991633;AKOS006083538;EN300-1862106;3-([1,1'-Biphenyl]-4-yl)-3-hydroxypropanoic acid

Chemical Property of beta-Hydroxy-(1,1'-biphenyl)-4-propanoic acid

Chemical Property:

• Vapor Pressure: 8.56E-09mmHg at 25°C
• Boiling Point: 447.5°C at 760 mmHg
• Flash Point: 238.6°C
• PSA: 57.53000
• Density: 1.23g/cm³
• LogP: 2.86170
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 242.094294304
• Heavy Atom Count: 18
• Complexity: 263

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=C(C=C2)C(CC(=O)O)O

Technology Process of beta-Hydroxy-(1,1'-biphenyl)-4-propanoic acid

There total 4 articles about beta-Hydroxy-(1,1'-biphenyl)-4-propanoic acid 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: 95.0%

methyl 3-([1,1'-biphenyl]-4-yl)-3-hydroxypropanoate → 3-([1,1'-biphenyl]-4-yl)-3-hydroxypropanoic acid (71315-37-2)

Guidance literature:

With lithium hydroxide monohydrate; In methanol; water; at -78 ℃; for 6h;

Reference yield:

biphenyl-4-methylchloride (1667-11-4) → 3-([1,1'-biphenyl]-4-yl)-3-hydroxypropanoic acid (71315-37-2)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous acetic acid

2: zinc

With acetic acid; zinc;

DOI:10.1021/ja01570a057

Reference yield:

ethyl bromoacetate (105-36-2) + 4-Phenylbenzaldehyde (3218-36-8) → 3-([1,1'-biphenyl]-4-yl)-3-hydroxypropanoic acid (71315-37-2)

Guidance literature:

With zinc;

DOI:10.1021/ja01570a057

upstream raw materials:

ethyl bromoacetate

4-Phenylbenzaldehyde

biphenyl-4-methylchloride