2'-Chloro-[1,1'-biphenyl]-2-carboxylic acid

Base Information

• Chemical Name: 2'-Chloro-[1,1'-biphenyl]-2-carboxylic acid
• CAS No.: 14498-95-4
• Molecular Formula: C13H9 Cl O2
• Molecular Weight: 232.66
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID10373474
• Nikkaji Number: J325.064D
• Wikidata: Q82161654
• Mol file: 14498-95-4.mol

Synonyms:14498-95-4;2'-Chloro-[1,1'-biphenyl]-2-carboxylic acid;2-(2-chlorophenyl)benzoic Acid;2'-Chlorobiphenyl-2-carboxylic acid;2-Biphenyl-2'-chlorocarboxylic acid;2-BIPHENYL-2'-CHLORO-CARBOXYLIC ACID;2'-Chloro-2-biphenylcarboxylic acid;2-Biphenyl-2'-chloro-carboxylicacid;2'-Chloro-biphenyl-2-carboxylic acid;(chlorophenyl)benzoic acid;2-chlorophenylbenzoic acid;2'-Chloro-[1,1'-biphenyl]-2-carboxylicacid;SCHEMBL2930892;DTXSID10373474;AXQNGPFNBORSKU-UHFFFAOYSA-N;MFCD00093800;AKOS004117433;AB92551;PS-7692;AM20020500;BB 0222499;CS-0171213;FT-0688397;2'-chloro[1,1'-biphenyl]-2-carboxylic acid;[1,1'-Biphenyl]-2-carboxylic acid, 2'-chloro-;2\'-Chloro-[1,1\'-biphenyl]-2-carboxylic acid

Chemical Property of 2'-Chloro-[1,1'-biphenyl]-2-carboxylic acid

Chemical Property:

• Boiling Point: 355.2°Cat760mmHg
• Flash Point: 168.6°C
• PSA: 37.30000
• Density: 1.298g/cm³
• LogP: 3.70520
• Storage Temp.: 2-8°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 232.0291072
• Heavy Atom Count: 16
• Complexity: 254

Purity/Quality:

97% ^*data from raw suppliers

2''-Chloro-[1,1''-Biphenyl]-2-CarboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=CC=CC=C2Cl)C(=O)O

Technology Process of 2'-Chloro-[1,1'-biphenyl]-2-carboxylic acid

There total 10 articles about 2'-Chloro-[1,1'-biphenyl]-2-carboxylic 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:

C14H11ClO2 → 2'-chloro-[1,1'-biphenyl]-2-carboxylic acid (14498-95-4)

Guidance literature:

With potassium hydroxide; In methanol; Heating;

DOI:10.1021/jo701599g

Reference yield:

2-bromo-1-chlorobenzene (694-80-4) + carbon dioxide (124-38-9,18923-20-1) → 2'-chloro-[1,1'-biphenyl]-2-carboxylic acid (14498-95-4)

Guidance literature:

With n-butyllithium; diethyl ether;

DOI:10.1021/ja01591a053

Reference yield:

2-Chlorobenzeneboronic acid (3900-89-8) → 2'-chloro-[1,1'-biphenyl]-2-carboxylic acid (14498-95-4)

Guidance literature:

Multi-step reaction with 2 steps

1: bis-triphenylphosphine-palladium(II) chloride; sodium carbonate / tetrahydrofuran; water / 20 - 80 °C / Schlenk technique; Inert atmosphere

2: sodium hydroxide; water / tetrahydrofuran / 80 °C

With bis-triphenylphosphine-palladium(II) chloride; water; sodium carbonate; sodium hydroxide; In tetrahydrofuran; water; 1: |Suzuki Coupling;

DOI:10.1002/chem.201303511

upstream raw materials:

carbon dioxide

2-chloro-2'-iodobiphenyl

2-chloro-2'-methyl-1,1'-biphenyl

2-bromo-1-chlorobenzene

Downstream raw materials:

Bis-<2-(2-chlorphenyl)-benzoyl>-peroxid

6H-benzo[c]chromen-6-one

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