3-Amino-1,2,3,4-tetrahydro-2-oxo-8-quinolinecarboxylic Acid Monohydrochloride - CAS 113225-48-2
Catalog: |
BB074477 |
Product Name: |
3-Amino-1,2,3,4-tetrahydro-2-oxo-8-quinolinecarboxylic Acid Monohydrochloride |
CAS: |
113225-48-2 |
Synonyms: |
3-Amino-1,2,3,4-tetrahydro-2-oxo-8-quinolinecarboxylic Acid Monohydrochloride; 3-amino-2-oxo-3,4-dihydro-1H-quinoline-8-carboxylic acid; hydrochloride; 3-Amino-2-oxo-1,2,3,4-tetrahydroquinoline-8-carboxylic acid hydrochloride |
IUPAC Name: | 3-amino-2-oxo-3,4-dihydro-1H-quinoline-8-carboxylic acidhydrochloride |
Molecular Weight: | 242.66 |
Molecular Formula: | C10H11ClN2O3 |
Canonical SMILES: | C1C(C(=O)NC2=C1C=CC=C2C(=O)O)N.Cl |
InChI: | InChI=1S/C10H10N2O3.ClH/c11-7-4-5-2-1-3-6(10(14)15)8(5)12-9(7)13/h1-3,7H,4,11H2,(H,12,13)(H,14,15)1H |
InChI Key: | QAUDMCZYWRJIQO-UHFFFAOYSA-N |
Complexity: | 292 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.0458199 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.0458199 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 92.4Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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