| CAS Number | 1026861-70-0 |
| Catalog Number | AG01B2S0 |
| Chemical Name | 4-Chloro-8-fluoro-3-nitroquinoline |
| IUPAC Name | 4-chloro-8-fluoro-3-nitroquinoline |
| InChI | InChI=1S/C9H4ClFN2O2/c10-8-5-2-1-3-6(11)9(5)12-4-7(8)13(14)15/h1-4H |
| InChI Key | IYGRDXZBIHWZNR-UHFFFAOYSA-N |
| MDL Number | MFCD29048261 |
| Molecular Formula | C9H4ClFN2O2 |
| Molecular Weight | 226.5917 |
| SMILES | [O-][N+](C1=C(Cl)C2=C(C(=CC=C2)F)N=C1)=O |
| Synonyms | 4-chloro-8-fluoro-3-nitroquinoline,
1026861-70-0,
SCHEMBL10040154,
ZINC39076505,
4-chloro-8-fluoro-3-nitro-quinoline,
CID10609318,
|
| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.591g/mol |
| Monoisotopic Mass | 225.995g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 58.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number