| CAS Number | 32890-65-6 |
| Catalog Number | AG00CKIX(AGN-PC-00HGHW) |
| Chemical Name | 4-methyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid |
| IUPAC Name | 4-methyl-2-oxo-1H-quinoline-3-carboxylic acid |
| InChI | InChI=1S/C11H9NO3/c1-6-7-4-2-3-5-8(7)12-10(13)9(6)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15) |
| InChI Key | YRDMEJCIOSSLMD-UHFFFAOYSA-N |
| MDL Number | MFCD11557114 |
| Molecular Formula | C11H9NO3 |
| Molecular Weight | 203.1941 |
| SMILES | CC1=C(C(=O)NC2=CC=CC=C12)C(=O)O |
| Synonyms | 2-hydroxy-4-methylquinoline-3-carboxylic acid,
4-methyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid,
32890-65-6,
SCHEMBL1037203,
STL279600,
STL301094,
ZINC26506349,
4-methylcarbostyril-3-carboxylic acid,
AKOS016377090,
AKOS022125444,
MCULE-6506224248,
NE24709,
2-Hydroxy-4-methyl-3-quinolinecarboxylic acid,
2-Oxo-4-methyl-1,2-dihydroquinoline-3-carboxylic acid,
Z1350606451,
CID11850972,
4-methyl-2-oxo-1H-quinoline-3-carboxylic Acid,
|
| Complexity | 346 |
| 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 | 3 |
| 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 | 66.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number