5-(o-Tolyl)furan-2-carboxylic acid

Base Information

Chemical Name:5-(o-Tolyl)furan-2-carboxylic acid
CAS No.:80174-04-5
Molecular Formula:C12H10O3
Molecular Weight:202.21
Hs Code.:2932190090
ChEMBL ID:CHEMBL3903463
DSSTox Substance ID:DTXSID40409194
Nikkaji Number:J3.609.750G
Wikidata:Q82214914
Mol file:80174-04-5.mol

Synonyms:5-(o-Tolyl)furan-2-carboxylic acid;80174-04-5;5-(2-methylphenyl)furan-2-carboxylic Acid;5-(2-Methylphenyl)-2-furoic acid;5-(o-Tolyl)furan-2-carboxylicacid;5-(2-Methyl phenyl)-furan-2-carboxylic acid;5-tolylfuran-2-carboxylic acid;SCHEMBL4940503;CHEMBL3903463;DTXSID40409194;KUC100866N;AMY33183;MFCD04039143;AKOS004119262;SB61245;BB 0222391;5-(2-methylphenyl)-2-furoic acid, AldrichCPR

Suppliers and Price of 5-(o-Tolyl)furan-2-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

SynQuest Laboratories
5-(2-Methylphenyl)-2-furoicacid
5 g
$ 2040.00

SynQuest Laboratories
5-(2-Methylphenyl)-2-furoicacid
1 g
$ 792.00

Chemenu
5-(o-tolyl)furan-2-carboxylicacid 95%
5g
$ 556.00

Alichem
5-(o-Tolyl)furan-2-carboxylicacid
5g
$ 480.00

Total 6 raw suppliers

Chemical Property of 5-(o-Tolyl)furan-2-carboxylic acid

Chemical Property:

Melting Point:161-162 °C(Solv: benzene (71-43-2))
Boiling Point:355.5±30.0 °C(Predicted)
PKA:3.16±0.10(Predicted)
PSA：50.44000
Density:1 +-.0.06 g/cm3(Predicted)
LogP:2.95320
Storage Temp.:2-8°C
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:202.062994177
Heavy Atom Count:15
Complexity:239

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

5-(2-Methylphenyl)-2-furoicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=CC=C1C2=CC=C(O2)C(=O)O

Technology Process of 5-(o-Tolyl)furan-2-carboxylic acid

There total 5 articles about 5-(o-Tolyl)furan-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: 64.0%

: 110360-09-3
5-(2-methylphenyl)-2-furancarboxaldehyde

: 80174-04-5
5-(o-tolyl)-2-furoic acid

Guidance literature:: With silver nitrate; sodium hydroxide; In ethanol; water; for 2h; Heating;
DOI:10.1021/acs.jmedchem.1c01810

Reference yield:

: 5-(2-methylphenyl)furan-2-carboxylic acid methyl ester

: 80174-04-5
5-(o-tolyl)-2-furoic acid

Guidance literature:: With sodium hydroxide; In methanol; at 20 ℃; for 0.5h;
DOI:10.1016/j.bmcl.2018.12.058

Reference yield:

: 16419-60-6
2-Methylphenylboronic acid

: 80174-04-5
5-(o-tolyl)-2-furoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate / 1,4-dioxane / 5 h / 100 °C

2: sodium hydroxide / methanol / 0.5 h / 20 °C

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate; sodium hydroxide; In 1,4-dioxane; methanol; 1: |Suzuki Coupling;
DOI:10.1016/j.bmcl.2018.12.058