AG003N7L

328956-08-7 | 6-Fluoro-4-(trifluoromethyl)quinolin-2(1H)-one

AG003N7L

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CAS Number	328956-08-7
Catalog Number	AG003N7L(AGN-PC-00FBN7)
Chemical Name	6-Fluoro-4-(trifluoromethyl)quinolin-2(1H)-one
IUPAC Name	6-fluoro-4-(trifluoromethyl)-1H-quinolin-2-one
InChI	InChI=1S/C10H5F4NO/c11-5-1-2-8-6(3-5)7(10(12,13)14)4-9(16)15-8/h1-4H,(H,15,16)
InChI Key	WUFRBOSKPZUGIS-UHFFFAOYSA-N
MDL Number	MFCD17015723
Molecular Formula	C10H5F4NO
Molecular Weight	231.1464
SMILES	FC1=CC2=C(CC(=O)N=C2C=C1)C(F)(F)F
Synonyms	328956-08-7, 6-fluoro-4-(trifluoromethyl)-2(1h)-quinolinone, 6-FLUORO-4-(TRIFLUOROMETHYL)QUINOLIN-2-OL, 6-fluoro-4-(trifluoromethyl)-1H-quinolin-2-one, 4-Trifluoromethyl-6-fluoroquinolin-2-ol, SCHEMBL1771152, CTK4G9515, DTXSID50471761, ANW-65383, CT-814, MFCD17015723, TD8163, ZINC36405633, AKOS016005229, AKOS025402007, AC-28128, ACM328956087, AJ-92772, AN-28830, DB-002612, 4CH-021732, FT-0645327, Z3039, 2(1H)-Quinolinone,6-fluoro-4-(trifluoromethyl)-, 6-Fluoro-4-(trifluoromethyl)quinoline-2(1H)-one, 956F087, A821501, 6-fluoranyl-4-(trifluoromethyl)-1H-quinolin-2-one, 6-Fluoro-4-(trifluoromethyl)quinolin-2(1H)-one, C10H5F4NO, 6-Fluoro-4- -2 -quinolinone, ACN-051875, CID11746469,

Complexity	336
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	231.031g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	231.15g/mol
Monoisotopic Mass	231.031g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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