| CAS Number | 888014-11-7 |
| Catalog Number | AG01DWSL |
| Chemical Name | 2-ethylquinoline-3-carboxylic acid hydrochloride |
| IUPAC Name | 2-ethylquinoline-3-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C12H11NO2.ClH/c1-2-10-9(12(14)15)7-8-5-3-4-6-11(8)13-10;/h3-7H,2H2,1H3,(H,14,15);1H |
| InChI Key | LOROPDPYYRUCDF-UHFFFAOYSA-N |
| MDL Number | MFCD26383500 |
| Molecular Formula | C12H12ClNO2 |
| Molecular Weight | 237.6822 |
| SMILES | Cl.CCC1=C(C(O)=O)C=C2C(C=CC=C2)=N1 |
| Synonyms | 2-ETHYL-3-QUINOLINECARBOXYLIC ACID HYDROCHLORIDE,
888014-11-7,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.683g/mol |
| Monoisotopic Mass | 237.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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