1-Ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid

Base Information

• Chemical Name: 1-Ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid
• CAS No.: 114609-86-8
• Molecular Formula: C11H7F3N2O3
• DSSTox Substance ID: DTXSID40556293
• Wikidata: Q82437802
• Mol file: 114609-86-8.mol

Synonyms:114609-86-8;SCHEMBL10721811;DTXSID40556293;1-Ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid

Chemical Property of 1-Ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydrocinnoline-3-carboxylic acid

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 272.04087658
• Heavy Atom Count: 19
• Complexity: 443

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C2=C(C(=C(C=C2C(=O)C(=N1)C(=O)O)F)F)F

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