3-(3,4-dichlorophenyl)benzoic Acid

Base Information

Chemical Name:3-(3,4-dichlorophenyl)benzoic Acid
CAS No.:844878-91-7
Molecular Formula:C₁₃H₈Cl₂O₂
Molecular Weight:267.111
Hs Code.:2916399090
DSSTox Substance ID:DTXSID00374197
Wikidata:Q82162704
Mol file:844878-91-7.mol

Synonyms:3-(3,4-dichlorophenyl)benzoic Acid;844878-91-7;3',4'-Dichloro-[1,1'-biphenyl]-3-carboxylic acid;3',4'-Dichlorobiphenyl-3-carboxylic acid;3',4'-Dichloro-[1,1'-biphenyl]-3-carboxylicacid;SCHEMBL3540530;DTXSID00374197;MFCD06201435;AKOS000124337;3,4-Dichlorobiphenyl-3-carboxylic acid;BS-24330;CS-0208746;A50550

Suppliers and Price of 3-(3,4-dichlorophenyl)benzoic 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
3-(3,4-Dichlorophenyl)benzoicacid
25mg
$ 45.00

Crysdot
3',4'-Dichloro-[1,1'-biphenyl]-3-carboxylicacid 95+%
1g
$ 299.00

Crysdot
3',4'-Dichloro-[1,1'-biphenyl]-3-carboxylicacid 95+%
5g
$ 958.00

American Custom Chemicals Corporation
3',4'-DICHLORO-[1,1'-BIPHENYL]-3-CARBOXYLIC ACID 95.00%
5MG
$ 501.38

Alichem
3',4'-Dichloro-[1,1'-biphenyl]-3-carboxylicacid
1g
$ 258.64

AK Scientific
3',4'-Dichloro-[1,1'-biphenyl]-3-carboxylicacid
5g
$ 1651.00

Acrotein
3',4'-Dichlorobiphenyl-3-carboxylicacid 97%
1g
$ 293.33

Acrotein
3',4'-Dichlorobiphenyl-3-carboxylicacid 97%
0.5g
$ 174.17

Total 7 raw suppliers

Chemical Property of 3-(3,4-dichlorophenyl)benzoic Acid

Chemical Property:

PSA：37.30000
LogP:4.35860
Storage Temp.:2-8°C
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:265.9901349
Heavy Atom Count:17
Complexity:283

Purity/Quality:

97% ^*data from raw suppliers

3-(3,4-Dichlorophenyl)benzoicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 3-(3,4-dichlorophenyl)benzoic Acid

There total 2 articles about 3-(3,4-dichlorophenyl)benzoic 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:

: 151169-75-4
3,4-dichlophenylboronic acid

: 618-51-9
3-Iodobenzoic acid

: 844878-91-7
3',4'-dichloro[1,1‘-biphenyl]-3-carboxylic acid

Guidance literature:: With palladium diacetate; sodium carbonate; triphenylphosphine; In 1,2-dimethoxyethane; water; at 56 - 80 ℃; for 21h; Inert atmosphere;
DOI:10.1021/acs.orglett.8b02819

Reference yield:

: 844878-91-7
3',4'-dichloro[1,1‘-biphenyl]-3-carboxylic acid

Guidance literature:: With tetrakis(triphenylphosphine) palladium⁽⁰⁾; In N,N-dimethyl-formamide; at 20 ℃; for 0.166667h;

With caesium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 4h;

Reference yield:

: 844878-91-7
3',4'-dichloro[1,1‘-biphenyl]-3-carboxylic acid

: 1326777-62-1
3’-4’-dichloro-N-((4-(4-ethoxyphenoxy)phenyl)sulfonyl)[1,1’-biphenyl]-3-carboxamide

Guidance literature:: Multi-step reaction with 2 steps

1: N,N-dimethyl-formamide; oxalyl dichloride / tetrahydrofuran / Inert atmosphere

2: triethylamine; dmap / ethyl acetate; toluene / 5 h / 55 °C / Inert atmosphere

With dmap; oxalyl dichloride; triethylamine; N,N-dimethyl-formamide; In tetrahydrofuran; ethyl acetate; toluene;
DOI:10.1021/acs.orglett.8b02819