AG000DIJ

117-57-7 | 4-Quinolinecarboxylic acid, 3-hydroxy-2-methyl-

AG000DIJ

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CAS Number	117-57-7
Catalog Number	AG000DIJ(AGN-PC-0JL7K3)
Chemical Name	4-Quinolinecarboxylic acid, 3-hydroxy-2-methyl-
EC Number	204-198-1
IUPAC Name	3-hydroxy-2-methylquinoline-4-carboxylic acid
InChI	InChI=1S/C11H9NO3/c1-6-10(13)9(11(14)15)7-4-2-3-5-8(7)12-6/h2-5,13H,1H3,(H,14,15)
InChI Key	RVGATDHHYVSTQG-UHFFFAOYSA-N
MDL Number	MFCD00044850
Molecular Formula	C11H9NO3
Molecular Weight	203.1941
NSC Number	64848
SMILES	O=C(C1=C(O)C(C)=NC2=CC=CC=C12)O
Synonyms	117-57-7, 3-Hydroxy-2-methylquinoline-4-carboxylic acid, 3-Hydroxy-2-methyl-4-quinolinecarboxylic acid, 4-Quinolinecarboxylic acid, 3-hydroxy-2-methyl-, 2-Methyl-3-hydroxy-quinoline-4-carboxylic acid, 2-methyl-3-hydroxyquinoline-4-carboxylic acid, 3-Hydroxy-4-carboxyquinaldine, RVGATDHHYVSTQG-UHFFFAOYSA-N, 3-Hydroxy-2-methylcinchoninic acid, 3-Hydroxy-4-quinaldinecarboxylic acid, 3-Hydroxyquinaldine-4-carboxylic acid, Cinchoninic acid, 3-hydroxy-2-methyl-, AK-86415, 3-hydroxy-2-methyl-quinoline-4-carboxylic acid, W-108563, NSC64848, EINECS 204-198-1, Oxychinaldincarbonsaure, PubChem7563, 3-hydroxy-quinaldine-4-carboxylic acid, AC1Q5TKI, Maybridge1_004368, timtec-bb sbb000417, AC1L26OK, Cambridge id 6675776, 1-Methyl-4-Hydroxyquinoline, Oprea1_399799, 3-Oxyquinaldine-4-carboxylic, AC1Q2P83, SCHEMBL1527122, Jsp001192, DTXSID5059458, 3-hydroxyquinaldine-4-carboxylic, CTK0H6254, HMS553O14, ZINC119714, ACT01941, EBD17771, KS-00000NC1, 3-hydroxy-2-methyl cinchoninic acid, ANW-46266, BBL005247, MFCD00044850, NSC-64848, SBB000417, STK368241, AKOS003601411, CCG-253871, MCULE-4036961118, TRA0057926, AC-11578, AN-43236, CC-11349, SC-76967, ST086496, TS-02889, 3-hydroxy-2-methyl-4-quinolinecarboxylicaci, AX8008108, DB-004304, ST2405093, TC-135011, FT-0631671, 3-hydroxy-2-methyl-4-quinolincarboxylic acid, 3-hydroxy-2-methyl-4-quinoline carboxylic acid, 3-hydroxy-2-methyl-quinolin-4-carboxylic acid, 4-Quinolinecarboxylicacid, 3-hydroxy-2-methyl-, K-1211, 3-Hydroxy-2-methyl-4-quinolinecarboxylic acid #, 117H577, C-09847, I08-0072, 3-Hydroxy-2-methyl-4-quinolinecarboxylic acid, 97%, C11H9NO3, C11-H9-N-O3, CID67024, AR-1F3564, QUINOLINE-4-CARBOXYLIC ACID, 3-HYDROXY-2-METHYL-, 119237-64-8,

Complexity	256
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.058g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	203.197g/mol
Monoisotopic Mass	203.058g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	70.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number