AG000263

100501-62-0 | Ethyl 1-ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate

AG000263

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CAS Number	100501-62-0
Catalog Number	AG000263(AGN-PC-0LNBVE)
Chemical Name	Ethyl 1-ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate
EC Number	405-880-3
IUPAC Name	ethyl 1-ethyl-6,7,8-trifluoro-4-oxoquinoline-3-carboxylate
InChI	InChI=1S/C14H12F3NO3/c1-3-18-6-8(14(20)21-4-2)13(19)7-5-9(15)10(16)11(17)12(7)18/h5-6H,3-4H2,1-2H3
InChI Key	LWLLHOVWIFISMG-UHFFFAOYSA-N
MDL Number	MFCD00276022
Molecular Formula	C14H12F3NO3
Molecular Weight	299.2452
SMILES	CCOC(=O)C1=CN(CC)C2=C(C=C(F)C(F)=C2F)C1=O
Synonyms	100501-62-0, Ethyl 1-ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate, Ethyl 1-ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate, 1-ETHYL-6,7,8-TRIFLUORO-1,4-DIHYDRO-4-OXO-3-QUINOLINECARBOXYLIC ACID ETHYL ESTER, MFCD00276022, 1-Ethyl-6,7,8-trifluoro-1,4-dihydro -4-oxohydroquinoline-3-carboxylic acid ethyl ester, Ethyl 1-Ethyl-6,7,8-Trifluoro-1,4-Dihydro-4-Oxoquinoline-3-Carboxylate (Dry wt.), May Cont. up to 5% Water, ETHYL 1-ETHYL-6,7,8-TRIFLUORO-1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLATE;Ethyl 1-ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate, LWLLHOVWIFISMG-UHFFFAOYSA-N, ACMC-1BRCG, AC1NOMY6, KSC499A1T, SCHEMBL6756451, CTK3J9019, KS-00000YOG, DTXSID80408707, Ethyl 1-ethyl-6,7,8-trifluoro-4-oxo-quinoline-3-carboxylate, ZINC404009, BCP12624, ANW-58957, AKOS015914669, CM14474, MCULE-8821940306, VQ10048, AJ-22195, AK-55671, AN-34435, CC-04489, CJ-03933, N708, Neopentyl glycol-tetrahydrofuran copolymer, ZB013340, AX8015257, DB-019172, RT-004386, TL8000055, E0888, FT-0642424, 501E620, A800219, C-18700, J-000150, I14-41910, 2,2-Dimethyl-1,3-propanediol-tetramethylene oxide copolymer, ethyl 1-ethyl-6,7,8-trifluoro-4-oxoquinoline-3-carboxylate, 1-ethyl-6,7,8-trifluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester, Ethyl 1-Ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylate, 1-ethyl-1,4-dihydro-6,7,8-trifluoro-4-oxo-3-quinolinecarboxylic acid, ethyl ester, 1-Ethyl-4-oxo-6,7,8-trifluoro-1,4-dihydroquinoline-3-carboxylic acid ethyl ester, 3-Quinolinecarboxylic acid, 1-ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-, ethyl ester, 3-Quinolinecarboxylicacid, 1-ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-, ethyl ester, Ethyl 1-ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate, 97%, ethyl 1-ethyl-6,7,8-tris(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate, C14H12F3NO3, CID5140913, EC 405-880-3, Ethyl-1-ethyl-6,7,8-trifluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate, Ethyl-6,7,8-trifluoro-N-ethyl-2,5-thihydro-4-oxo-3-quinoline carboxylate,

Complexity	468
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	299.077g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	299.249g/mol
Monoisotopic Mass	299.077g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H412
Packing Group
Precautionary statements	P273-P280
UN Code

Certificate of Analysis

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