| CAS Number | 1061650-25-6 |
| Catalog Number | AG0095V2(AGN-PC-0H7LY8) |
| Chemical Name | 8-fluoro-quinoline-6-carboxylic acid |
| IUPAC Name | 8-fluoroquinoline-6-carboxylic acid |
| InChI | InChI=1S/C10H6FNO2/c11-8-5-7(10(13)14)4-6-2-1-3-12-9(6)8/h1-5H,(H,13,14) |
| InChI Key | KKAGDSDXDXTTMJ-UHFFFAOYSA-N |
| MDL Number | MFCD20660878 |
| Molecular Formula | C10H6FNO2 |
| Molecular Weight | 191.1585 |
| SMILES | FC=1C=C(C=C2C=CC=NC12)C(=O)O |
| Synonyms | 8-fluoroquinoline-6-carboxylic acid,
1061650-25-6,
SCHEMBL1223701,
KKAGDSDXDXTTMJ-UHFFFAOYSA-N,
ZINC82770061,
8-fluoro-quinoline-6-carboxylic acid,
AKOS022883134,
6-Quinolinecarboxylic acid, 8-fluoro-,
Z2755724137,
8-fluoroquinoline-6-carboxylicacid,
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| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.161g/mol |
| Monoisotopic Mass | 191.038g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number