| CAS Number | 1167056-89-4 |
| Catalog Number | AG000D4I(AGN-PC-09SJ42) |
| Chemical Name | 6-Fluoro-3-hydroxy-quinoline-4-carboxylic acid |
| IUPAC Name | 6-fluoro-3-hydroxyquinoline-4-carboxylic acid |
| InChI | InChI=1S/C10H6FNO3/c11-5-1-2-7-6(3-5)9(10(14)15)8(13)4-12-7/h1-4,13H,(H,14,15) |
| InChI Key | UPTVMNMTVAWXBH-UHFFFAOYSA-N |
| MDL Number | MFCD12405088 |
| Molecular Formula | C10H6FNO3 |
| Molecular Weight | 207.1579 |
| SMILES | OC(C1=C2C(C=CC(=C2)F)=NC=C1O)=O |
| Synonyms | 6-fluoro-3-hydroxyquinoline-4-carboxylic acid,
1167056-89-4,
4-Quinolinecarboxylic acid, 6-fluoro-3-hydroxy-,
SCHEMBL15491648,
ZINC44185133,
AKOS015052590,
Z2010009908,
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| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.16g/mol |
| Monoisotopic Mass | 207.033g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 70.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
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