3-Imino-6-oxocyclohexa-1,4-diene-1-carboxylic acid

Base Information

Chemical Name:3-Imino-6-oxocyclohexa-1,4-diene-1-carboxylic acid
CAS No.:143228-42-6
Molecular Formula:C₇H₅NO₃
Molecular Weight:151.122
Hs Code.:
DSSTox Substance ID:DTXSID90577574
Nikkaji Number:J646.154I
Wikidata:Q82467619
Mol file:143228-42-6.mol

Synonyms:143228-42-6;3-Imino-6-oxocyclohexa-1,4-diene-1-carboxylic acid;3-Imino-6-oxo-1,4-cyclohexadiene-1-carboxylic Acid;1,4-Cyclohexadiene-1-carboxylicacid,3-imino-6-oxo-(9CI);DTXSID90577574;3-Imino-6-oxocyclohexa-1,4-dienecarboxylic acid

Suppliers and Price of 3-Imino-6-oxocyclohexa-1,4-diene-1-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

Total 4 raw suppliers

Chemical Property of 3-Imino-6-oxocyclohexa-1,4-diene-1-carboxylic acid

Chemical Property:

Boiling Point:337.7±42.0 °C(Predicted)
PKA:-0.52±0.20(Predicted)
PSA：78.22000
Density:1.43±0.1 g/cm3(Predicted)
LogP:0.25580
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:151.026943022
Heavy Atom Count:11
Complexity:299

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=O)C(=CC1=N)C(=O)O
Uses The oxidation product of the anti-inflammatory agent Mesalazine (M258100).

Technology Process of 3-Imino-6-oxocyclohexa-1,4-diene-1-carboxylic acid

There total 1 articles about 3-Imino-6-oxocyclohexa-1,4-diene-1-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: