≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
A metabolite of the fluorinated quinolone anti-bacterial Ciprofloxacin.
| Pubchem Sid | 528772537 |
|---|---|
| Sorrisi canonici | C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNC(=O)C4)F)C(=O)O |
| IUPAC Name | 1-cyclopropyl-6-fluoro-4-oxo-7-(3-oxopiperazin-1-yl)quinoline-3-carboxylic acid |
| InChIKey | MYYZZOHRULFPOQ-UHFFFAOYSA-N |
| INCHI | 1S/C17H16FN3O4/c18-12-5-10-13(6-14(12)20-4-3-19-15(22)8-20)21(9-1-2-9)7-11(16(10)23)17(24)25/h5-7,9H,1-4,8H2,(H,19,22)(H,24,25) |
| Isomeri SMILES | C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNC(=O)C4)F)C(=O)O |
| Peso molecolare | 345.33 |
| Reaxy-Rn | 5360353 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5360353&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Classe | Quinolines and derivatives |
| Subclass | Quinoline carboxylic acids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Quinoline carboxylic acids |
| Alternative Parents | Fluoroquinolones N-arylpiperazines Alpha amino acid amides Haloquinolines Hydroquinolones Aminoquinolines and derivatives Hydroquinolines Pyridinecarboxylic acids Dialkylarylamines Aryl fluorides Benzenoids Heteroaromatic compounds Vinylogous amides Secondary carboxylic acid amides Lactams Amino acids Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Quinoline-3-carboxylic acid - Alpha-amino acid amide - Fluoroquinolone - N-arylpiperazine - Dihydroquinolone - Haloquinoline - Aminoquinoline - Alpha-amino acid or derivatives - Dihydroquinoline - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Piperazine - Pyridine - Aryl fluoride - Aryl halide - 1,4-diazinane - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Amino acid or derivatives - Lactam - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Aromatic heteropolycyclic compound |
| Descrizione | This compound belongs to the class of organic compounds known as quinoline carboxylic acids. These are quinolines in which the quinoline ring system is substituted by a carboxyl group at one or more positions. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Data | Oggetto |
|---|---|---|---|
 F2426398 | Certificate of Analysis | Jun 01, 2024 | O340802 |
| F2426399 | Certificate of Analysis | Jun 01, 2024 | O340802 |
| F2426400 | Certificate of Analysis | Jun 01, 2024 | O340802 |
| F2426401 | Certificate of Analysis | Jun 01, 2024 | O340802 |
| F2426408 | Certificate of Analysis | Jun 01, 2024 | O340802 |
| Solubilità | Soluble in Acetic Acid and Tetrahydrofuran |
|---|---|
| Indice di rifrazione | n20D1.67 (Predicted) |
| Punto di ebollizione (°C) | 682.32° C at 760 mmHg (Predicted) |
| Punto di fusione (°C) | >300° C |
| Peso molecolare | 345.320 g/mol |
| XLogP3 | 1.000 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 345.112 Da |
| Monoisotopic Mass | 345.112 Da |
| Topological Polar Surface Area | 90.000 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 648.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
