Nequinate

Base Information

• Chemical Name: Nequinate
• CAS No.: 13997-19-8
• Molecular Formula: C22H23NO4
• Molecular Weight: 365.43
• Hs Code.: 29334900
• European Community (EC) Number: 237-796-6
• UNII: 91ZE013933
• DSSTox Substance ID: DTXSID2048610
• Nikkaji Number: J8.469G
• Wikidata: Q27271439
• NCI Thesaurus Code: C76424
• Metabolomics Workbench ID: 45080
• ChEMBL ID: CHEMBL2104807
• Mol file: 13997-19-8.mol

Synonyms:methyl 7-(benzyloxy)-6-butyl-1,4-dihydro-4-oxo-3-quinolinecarboxylate;methylbenzoquate;nequinate;Statyl

Chemical Property of Nequinate

Chemical Property:

• Appearance/Colour: Light yellow, odorless powder.
• Vapor Pressure: 6.05E-11mmHg at 25°C
• Melting Point: 287.5oC
• Refractive Index: 1.579
• Boiling Point: 520.7 °C at 760 mmHg
• PKA: 1.06±0.70(Predicted)
• Flash Point: 268.7 °C
• PSA: 68.39000
• Density: 1.185 g/cm³
• LogP: 4.23630
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Acidic Methanol (Slightly, Heated, Sonicated)
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 365.16270821
• Heavy Atom Count: 27
• Complexity: 553

Purity/Quality:

99% ^*data from raw suppliers

Neqoinate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCC1=CC2=C(C=C1OCC3=CC=CC=C3)NC=C(C2=O)C(=O)OC
• Uses: Coccidiostatic Drugs of Quinolines Neqoinate, is an anticoccidial agent, preventing coccidiosis and developing immunity against five different species of Eimeria.