AG0026PD

179024-67-0 | 3-Quinolinecarboxylic acid, 4-chloro-6-fluoro-

AG0026PD

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CAS Number	179024-67-0
Catalog Number	AG0026PD(AGN-PC-0KUJPT)
Chemical Name	3-Quinolinecarboxylic acid, 4-chloro-6-fluoro-
IUPAC Name	4-chloro-6-fluoroquinoline-3-carboxylic acid
InChI	InChI=1S/C10H5ClFNO2/c11-9-6-3-5(12)1-2-8(6)13-4-7(9)10(14)15/h1-4H,(H,14,15)
InChI Key	NEMDTRIVHUEXJW-UHFFFAOYSA-N
MDL Number	MFCD06255123
Molecular Formula	C10H5ClFNO2
Molecular Weight	225.6036
SMILES	O=C(C1=C(Cl)C2=CC(F)=CC=C2N=C1)O
Synonyms	4-chloro-6-fluoroquinoline-3-carboxylic acid, 179024-67-0, AC1MQ5W4, SCHEMBL7496024, CTK0H1165, DTXSID90392547, MFCD06255123, ZINC33569985, AKOS002664598, ACM179024670, AJ-86204, AS-37438, AB0075828, AX8008280, 3-Quinolinecarboxylicacid, 4-chloro-6-fluoro-, X-1142, 3-Quinolinecarboxylic acid, 4-chloro-6-fluoro-, CID3446518, 4-chloro-6-fluoro-quinoline-3-carboxylic Acid, 4-Chloro-6-fluoro- quinoline-3-carboxylic acid,

Complexity	264
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.999g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	225.603g/mol
Monoisotopic Mass	224.999g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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