AG0004CY

101382-53-0 | 3-Quinolinecarboxaldehyde, 1,2-dihydro-6-methyl-2-oxo-

AG0004CY

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CAS Number	101382-53-0
Catalog Number	AG0004CY(AGN-PC-0JXW6O)
Chemical Name	3-Quinolinecarboxaldehyde, 1,2-dihydro-6-methyl-2-oxo-
IUPAC Name	6-methyl-2-oxo-1H-quinoline-3-carbaldehyde
InChI	InChI=1S/C11H9NO2/c1-7-2-3-10-8(4-7)5-9(6-13)11(14)12-10/h2-6H,1H3,(H,12,14)
InChI Key	ULNTVPBXVATJMS-UHFFFAOYSA-N
MDL Number	MFCD02227050
Molecular Formula	C11H9NO2
Molecular Weight	187.1947
SMILES	CC1=CC2=C(NC(=O)C(C=O)=C2)C=C1
Synonyms	101382-53-0, 6-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde, 2-hydroxy-6-methylquinoline-3-carbaldehyde, 6-methyl-2-oxo-1H-quinoline-3-carbaldehyde, 6-methyl-2-oxo-1,2-dihydro-3-quinolinecarbaldehyde, 6-Methyl-2-oxo-1,2-dihydro-quinoline-3-carbaldehyde, 3-Quinolinecarboxaldehyde,1,2-dihydro-6-methyl-2-oxo-, 6-methyl-2-oxo-1,2-dihydro-quinoline-3-carboxaldehyde, AC1LIKPQ, ACMC-20a3s7, Oprea1_320124, 1,2-Dihydro-6-methyl-2-oxoquinoline-3-carbaldehyde, SCHEMBL4106429, SCHEMBL16764423, CTK3J9733, DTXSID90358628, ULNTVPBXVATJMS-UHFFFAOYSA-N, methyloxodihydroquinolinecarbaldehyde, KS-000026GE, ZINC3865124, ANW-55829, BBL029816, MFCD02227050, SBB090568, STK877441, STL015206, AKOS000365926, AKOS004117353, CD-1130, MCULE-8561625338, RP11116, AJ-46258, BAS 02070742, 6-methyl-2-oxohydroquinoline-3-carbaldehyde, BB 0263140, FT-0681084, W-9936, H-20019, I08-764, 6-Methyl-2-oxo-1,2-dihydroquinolin-3-carbaldehyde, J-518887, 3-Quinolinecarboxaldehyde, 1,2-dihydro-6-methyl-2-oxo-, F0805-0004, 6-methyl-2-oxo-1,2-dihydroquinolin-3-carbaldehyde, AldrichCPR, CID906097, ZINC03865124,

Complexity	296
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	2
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	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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