AG00IIKX

948294-50-6 | 6,7-Dimethylquinoline-3-carboxylic acid

AG00IIKX

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CAS Number	948294-50-6
Catalog Number	AG00IIKX(AGN-PC-0WD2DU)
Chemical Name	6,7-Dimethylquinoline-3-carboxylic acid
IUPAC Name	6,7-dimethylquinoline-3-carboxylic acid
InChI	InChI=1S/C12H11NO2/c1-7-3-9-5-10(12(14)15)6-13-11(9)4-8(7)2/h3-6H,1-2H3,(H,14,15)
InChI Key	PJSIIXYYIBFANC-UHFFFAOYSA-N
MDL Number	MFCD09787801
Molecular Formula	C12H11NO2
Molecular Weight	201.2212
SMILES	O=C(C1=CC2=CC(C)=C(C)C=C2N=C1)O
Synonyms	6,7-Dimethylquinoline-3-carboxylic acid, 948294-50-6, SCHEMBL10541769, CTK8E5316, DTXSID80589121, MFCD09787801, ZINC32099533, AB52272, AJ-84689, OR307998, AX8255793, DB-080109, RT-010475, FT-0743381, T6833, 6,7-Dimethylquinoline-3-carboxylic acid, AldrichCPR, 6,7-DIMETHYLQUINOLINE-3-CARBOXYLICACID,

Complexity	254
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.079g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	201.225g/mol
Monoisotopic Mass	201.079g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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