Ethyl 7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate - CAS 96568-07-9
Catalog: |
BB041992 |
Product Name: |
Ethyl 7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate |
CAS: |
96568-07-9 |
Synonyms: |
7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid ethyl ester; ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate |
IUPAC Name: | ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate |
Description: | Ethyl 7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate (CAS# 96568-07-9) is a fluoroquinolone derivative used in the preparation of antibacterial agents. |
Molecular Weight: | 310.71 |
Molecular Formula: | C14H12ClFN2O3 |
Canonical SMILES: | CCOC(=O)C1=CN(C2=NC(=C(C=C2C1=O)F)Cl)C3CC3 |
InChI: | InChI=1S/C14H12ClFN2O3/c1-2-21-14(20)9-6-18(7-3-4-7)13-8(11(9)19)5-10(16)12(15)17-13/h5-7H,2-4H2,1H3 |
InChI Key: | RWCZOVMOKFTUAD-UHFFFAOYSA-N |
Boiling Point: | 464.2 °C at 760 mmHg |
Density: | 1.511 g/cm3 |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD08458313 |
LogP: | 2.70060 |
Publication Number | Title | Priority Date |
DE-60314904-T2 | PROCESS FOR THE PREPARATION OF CHINOLONCARBOXYLATE DERIVATIVES | 20021221 |
JP-2006514033-A | Process for the preparation of quinolonecarboxylate derivatives | 20021221 |
JP-4310278-B2 | Process for the preparation of quinolonecarboxylate derivatives | 20021221 |
KR-100519158-B1 | A process for preparation of quinolone carboxylate derivatives | 20021221 |
KR-20040055527-A | A process for preparation of quinolone carboxylate derivatives | 20021221 |
Complexity: | 495 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 310.0520481 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 310.0520481 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 59.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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