AG00DACR

5350-94-7 | Ethyl 7-chloro-4-hydroxy-8-methylquinoline-3-carboxylate

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CAS Number	5350-94-7
Catalog Number	AG00DACR(AGN-PC-0SFD9X)
Chemical Name	Ethyl 7-chloro-4-hydroxy-8-methylquinoline-3-carboxylate
IUPAC Name	ethyl 7-chloro-8-methyl-4-oxo-1H-quinoline-3-carboxylate
InChI	InChI=1S/C13H12ClNO3/c1-3-18-13(17)9-6-15-11-7(2)10(14)5-4-8(11)12(9)16/h4-6H,3H2,1-2H3,(H,15,16)
InChI Key	HOKMOQAMIGSWSJ-UHFFFAOYSA-N
MDL Number	MFCD00173377
Molecular Formula	C13H12ClNO3
Molecular Weight	265.6923
NSC Number	83
SMILES	O=C(C1=C(O)C2=CC=C(Cl)C(C)=C2N=C1)OCC
Synonyms	5350-94-7, ethyl 7-chloro-4-hydroxy-8-methylquinoline-3-carboxylate, 7-Chloro-4-hydroxy-8-methylquinoline-3-carboxylic ethyl ester, ethyl 7-chloro-8-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylate, Ethyl 7-chloro-4-hydroxy-8-methyl-3-quinolinecarboxylate, J-650029, ethyl 7-chloro-8-methyl-4-oxo-1H-quinoline-3-carboxylate, NSC83, PubChem6005, ChemDiv3_001358, AC1Q3OS1, Oprea1_702588, Oprea1_780937, Oprea1_843113, ACMC-209l89, NSC-83, CTK4J8272, KS-00001YDT, DTXSID70276952, HMS1476N16, AC1L5661, ZINC8870910, ZX-AT012861, ANW-31783, MFCD00173377, SBB015380, STK850934, STL227823, AKOS000273085, AKOS002249944, AB04324, MCULE-1996761399, OR59329, IDI1_020324, AJ-59308, CJ-13590, ST014800, AX8231315, TR-018928, UX00000039, V6472, VU0512665-1, 6J-011, SR-01000432014, SR-01000432014-1, BRD-K15908846-001-01-8, F3173-0044, ethyl 7-chloro-8-methyl-4-oxohydroquinoline-3-carboxylate, 3-Quinolinecarboxylicacid, 7-chloro-4-hydroxy-8-methyl-, ethyl ester, 7-CHLORO-4-HYDROXY-8-METHYL-3-QUINOLINECARBOXYLIC ACID, ETHYL ESTER, 7-CHLORO-4-HYDROXY-8-METHYLQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER, C13H12ClNO3, AR-1I9562, CID219161, ETHYL7-CHLORO-4-HYDROXY-8-METHYLQUINOLINE-3-CARBOXYLATE, 6002-83-1,

Complexity	394
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.051g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	265.693g/mol
Monoisotopic Mass	265.051g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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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