CAS
635-46-1 Purity
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635-46-1 Purity
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Specification
The molecular formula is C10H6F3NO.
The molecular weight is 213.16 g/mol.
The IUPAC name is 8-(trifluoromethyl)-1H-quinolin-4-one.
The InChI is InChI=1S/C10H6F3NO/c11-10(12,13)7-3-1-2-6-8(15)4-5-14-9(6)7/h1-5H,(H,14,15).
The Canonical SMILES is C1=CC2=C(C(=C1)C(F)(F)F)NC=CC2=O.
The CAS number is 93919-57-4.
The ChEMBL ID is CHEMBL1530101.
The XLogP3-AA value is 2.4.
It has 1 hydrogen bond donor count.
It has 5 hydrogen bond acceptor counts.