AG0068N5

98349-25-8 | Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate

AG0068N5

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CAS Number	98349-25-8
Catalog Number	AG0068N5(AGN-PC-0W83YO)
Chemical Name	Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
EC Number	422-380-0
IUPAC Name	ethyl 1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylate
InChI	InChI=1S/C15H13F2NO3/c1-2-21-15(20)10-7-18(8-3-4-8)13-6-12(17)11(16)5-9(13)14(10)19/h5-8H,2-4H2,1H3
InChI Key	QYGNYHKBMNUIJN-UHFFFAOYSA-N
MDL Number	MFCD01646378
Molecular Formula	C15H13F2NO3
Molecular Weight	293.2654
SMILES	O=C(C1=CN(C2CC2)C3=C(C=C(F)C(F)=C3)C1=O)OCC
Synonyms	98349-25-8, ETHYL 1-CYCLOPROPYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLATE, AK320542, 3-Quinolinecarboxylic acid,1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-, ethyl ester, QYGNYHKBMNUIJN-UHFFFAOYSA-N, ACMC-20m2a9, SCHEMBL4306583, CTK5H9824, KS-00000PLW, DTXSID50431269, BCP13372, ZINC2382962, CL1050, MFCD01646378, DS-11689, SC-82334, AB0087343, ETHYL 1-CYCLOPROPYL-6,7-DIFLUORO-4-OXO-1,4-DIHYDRO, ethyl 1-cyclopropyl-6,7-difluoro-4-oxoquinoline-3-carboxylate, ethyl 1-cyclopropyl-1,4-dihydro-6,7-difluoro-4-oxo-quinoline-3-carboxylate, ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinoline-carboxylate, ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylate, ethyl 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylate, ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate, 1-cyclopropyl-6,7-difluoro- 1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, ethyl ester, 1-cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, ethyl ester, 1-Cyclopropyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid ethyl ester, CID9817544, EC 422-380-0, Ethyl 1-cyclopropyl-6,7-difluoro-4-oxo-quinoline-3-carboxylate,

Complexity	489
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	293.086g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	293.27g/mol
Monoisotopic Mass	293.086g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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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