4'-Acetylbiphenyl-3-carboxylic acid

Base Information

Chemical Name:4'-Acetylbiphenyl-3-carboxylic acid
CAS No.:635757-61-8
Molecular Formula:C₁₅H₁₂O₃
Molecular Weight:240.258
Hs Code.:2918300090
DSSTox Substance ID:DTXSID10399790
Wikidata:Q82202520
ChEMBL ID:CHEMBL4173948
Mol file:635757-61-8.mol

Synonyms:635757-61-8;4'-Acetylbiphenyl-3-carboxylic acid;3-(4-acetylphenyl)benzoic Acid;4'-Acetyl-[1,1'-biphenyl]-3-carboxylic acid;4'-Acetyl-biphenyl-3-carboxylic acid;4'-acetyl[1,1'-biphenyl]-3-carboxylic acid;SCHEMBL5517654;CHEMBL4173948;DTXSID10399790;MFCD04039045;AKOS004114130;BS-29005;BB 0222545;CS-0206709;4'-Acetyl-[1,1'-biphenyl]-3-carboxylicacid;A868100;4 inverted exclamation marka-Acetyl[1,1 inverted exclamation marka-biphenyl]-3-carboxylic acid

Suppliers and Price of 4'-Acetylbiphenyl-3-carboxylic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
4''-Acetylbiphenyl-3-carboxylicacid
100mg
$ 60.00

Crysdot
4'-Acetyl-[1,1'-biphenyl]-3-carboxylicacid 95+%
5g
$ 452.00

American Custom Chemicals Corporation
4'-ACETYL[1,1'-BIPHENYL]-3-CARBOXYLIC ACID 95.00%
5G
$ 1661.47

Alichem
4'-Acetyl-[1,1'-biphenyl]-3-carboxylicacid
5g
$ 446.88

Total 8 raw suppliers

Chemical Property of 4'-Acetylbiphenyl-3-carboxylic acid

Chemical Property:

Boiling Point:447.5±28.0 °C(Predicted)
PKA:4.02±0.10(Predicted)
PSA：54.37000
Density:1.208±0.06 g/cm3(Predicted)
LogP:3.25440
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:240.078644241
Heavy Atom Count:18
Complexity:316

Purity/Quality:

97% ^*data from raw suppliers

4''-Acetylbiphenyl-3-carboxylicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 4'-Acetylbiphenyl-3-carboxylic acid

There total 2 articles about 4'-Acetylbiphenyl-3-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: 85.0%

: 25487-66-5
3-Carboxyphenylboronic acid

: 99-90-1
para-bromoacetophenone

: 635757-61-8
4'-acetylbiphenyl-3-carboxylic acid

Guidance literature:: With tetrabutylammomium bromide; sodium carbonate; palladium; In water; at 100 ℃; for 2.5h;
DOI:10.1023/A:1026097813946

Reference yield: 54.0%

: 585-76-2
m-bromobenzoic acid

: 149104-90-5
4-acetylphenylboronic acid

: 635757-61-8
4'-acetylbiphenyl-3-carboxylic acid

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; potassium phosphate; In 1,4-dioxane; water; at 95 ℃; Inert atmosphere;
DOI:10.1016/j.ejmech.2017.12.085

Reference yield:

: 635757-61-8
4'-acetylbiphenyl-3-carboxylic acid

: 5-(3'-carboxy-biphenyl-4-yl)-1-(2,4-dichloro-phenyl)-1H-pyrazole-3-carboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1: LiN(TMS)2

2: H⁺ / ethanol

3: aq. NaOH

With sodium hydroxide; hydrogen cation; lithium hexamethyldisilazane; In ethanol;
DOI:10.1016/S0960-894X(03)00298-1