AG007MZC

254883-95-9 | 6-methylquinoline-3-carboxylic acid

AG007MZC

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CAS Number	254883-95-9
Catalog Number	AG007MZC(AGN-PC-0WD2DY)
Chemical Name	6-methylquinoline-3-carboxylic acid
IUPAC Name	6-methylquinoline-3-carboxylic acid
InChI	InChI=1S/C11H9NO2/c1-7-2-3-10-8(4-7)5-9(6-12-10)11(13)14/h2-6H,1H3,(H,13,14)
InChI Key	XILGKXKKWQIQNQ-UHFFFAOYSA-N
MDL Number	MFCD09787840
Molecular Formula	C11H9NO2
Molecular Weight	187.1947
SMILES	CC1=CC2=C(N=CC(C(O)=O)=C2)C=C1
Synonyms	6-Methylquinoline-3-carboxylic acid, 254883-95-9, SCHEMBL7728789, CTK8E5441, DTXSID30562883, FCH836564, MFCD09787840, ZINC26475174, AKOS006282349, 3-Quinolinecarboxylic acid, 6-methyl-, AB52359, ACM254883959, AJ-82448, OR309217, AX8255800, DB-067407, RT-010691, FT-0701843, T6464, 6-methylquinoline-3-carboxylic acid, AldrichCPR, J-016014, 6-METHYLQUINOLINE-3-CARBOXYLICACID,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.063g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	187.198g/mol
Monoisotopic Mass	187.063g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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

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