AG004WVV

85870-47-9 | Ethyl 2-hydroxyquinoline-3-carboxylate

AG004WVV

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CAS Number	85870-47-9
Catalog Number	AG004WVV(AGN-PC-0JTDXF)
Chemical Name	Ethyl 2-hydroxyquinoline-3-carboxylate
IUPAC Name	ethyl 2-oxo-1H-quinoline-3-carboxylate
InChI	InChI=1S/C12H11NO3/c1-2-16-12(15)9-7-8-5-3-4-6-10(8)13-11(9)14/h3-7H,2H2,1H3,(H,13,14)
InChI Key	POZIHPKRJFLANV-UHFFFAOYSA-N
MDL Number	MFCD00572653
Molecular Formula	C12H11NO3
Molecular Weight	217.2206
SMILES	O=C(C1=CC2=C(NC1=O)C=CC=C2)OCC
Synonyms	Ethyl 2-oxo-1,2-dihydroquinoline-3-carboxylate, 85870-47-9, ETHYL 2-OXO-1,2-DIHYDRO-QUINOLINE-3-CARBOXYLATE, Ethyl 2-hydroxyquinoline-3-carboxylate, POZIHPKRJFLANV-UHFFFAOYSA-N, 2-Oxo-1,2-dihydro-quinoline-3-carboxylic acid ethyl ester, ethyl 2-oxo-1H-quinoline-3-carboxylate, BAS 00141366, 2-Hydroxy-quinoline-3-carboxylic acid ethyl ester, 1,2-dihydro-2-oxo-3-quinolinecarboxylic acid,ethyl ester, AC1LBULV, Oprea1_644440, Oprea1_663886, SCHEMBL1372751, CTK3C8042, DTXSID50343353, HMS1678I14, ZINC368699, MFCD00572653, 3-(Ethoxycarbonyl)-2-hydroxyquinoline, AKOS000622688, EK-0722, MCULE-9937289633, PB12173, KS-0000031B, AJ-20225, SY034550, AB0033362, 3-ethoxycarbonyl-2-oxo-1,2-dihydroquinoline, CS-0049503, FT-0693313, X6893, MFCD00572653 (95%), C-8598, Z-8975, Z-8978, Ethyl 2-oxo-1,2-dihydro-3-quinolinecarboxylate #, SR-01000315349, SR-01000315349-1, Quinoline-3-carboxylic acid, 2-hydroxy-, ethyl ester, 3-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, ethyl ester, Quinoline-3-carboxylic acid, 1,2-dihydro-2-oxo-, ethyl ester, 2-OXO-1,2-DIHYDROQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER, C12H11NO3, CID589276, ZINC00368699, Ethyl2-oxo-1,2-dihydroquinoline-3-carboxylate,

Complexity	335
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.074g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	217.224g/mol
Monoisotopic Mass	217.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

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