1-Ethyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Base Information

• Chemical Name: 1-Ethyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
• CAS No.: 70032-25-6
• Molecular Formula: C12H9 F2 N O3
• Molecular Weight: 253.205
• DSSTox Substance ID: DTXSID90355430
• Nikkaji Number: J2.303.605C
• Wikidata: Q82134330
• ChEMBL ID: CHEMBL4638839
• Mol file: 70032-25-6.mol

Synonyms:1-ethyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;70032-25-6;1-ethyl-6,7-difluoro-4-oxoquinoline-3-carboxylic acid;ChemDiv3_004317;Oprea1_440861;SCHEMBL501895;CHEMBL4638839;DTXSID90355430;MHFJYVWFBPABTI-UHFFFAOYSA-N;HMS1485E05;CCG-22193;STK169676;AKOS000280066;BS-4671;SB70983;IDI1_022227;CS-0313437;1-ethyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic;1-ethyl-6 7-difluoro-1,4- dihydro-4-oxo-3-quinolinecarboxylic acid;1-ethyl-6,7-difluoro-1,4-dihydro-4- oxoquinoline-3-carboxylic acid;1-ethyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinoline carboxylic acid;1-ethyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinoline-carboxylic acid;1-ethyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid;1-ethyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid;1-ethyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid;1-ethyl-6,7-difluoro1,4-dihydro-4-oxo-3-quinolinecarboxylic acid;6,7-difluoro-1-ethyl-1,4-dihydro-4-oxoquinoline-3-carboxylic acid;1-ETHYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC ACID;294644-88-5

Chemical Property of 1-Ethyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Chemical Property:

• PSA: 59.30000
• LogP: 1.99780
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 253.05504947
• Heavy Atom Count: 18
• Complexity: 410

Purity/Quality:

99% ^*data from raw suppliers

1-Ethyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C=C(C(=O)C2=CC(=C(C=C21)F)F)C(=O)O