| CAS Number | 114417-35-5 |
| Catalog Number | AG00967A(AGN-PC-001JQI) |
| Chemical Name | 7-Fluoro-2,3-dihydroquinolin-4(1H)-one |
| IUPAC Name | 7-fluoro-2,3-dihydro-1H-quinolin-4-one |
| InChI | InChI=1S/C9H8FNO/c10-6-1-2-7-8(5-6)11-4-3-9(7)12/h1-2,5,11H,3-4H2 |
| InChI Key | PYOQBYNTTOIUIF-UHFFFAOYSA-N |
| MDL Number | MFCD13179234 |
| Molecular Formula | C9H8FNO |
| Molecular Weight | 165.1643 |
| SMILES | O=C1CCNC2=C1C=CC(F)=C2 |
| Synonyms | 7-fluoro-2,3-dihydro-1H-quinolin-4-one,
114417-35-5,
7-FLUORO-2,3-DIHYDROQUINOLIN-4(1H)-ONE,
EN300-80441,
SCHEMBL3105252,
PYOQBYNTTOIUIF-UHFFFAOYSA-N,
ZINC68575569,
AKOS022713757,
AB66651,
FCH1124053,
7-fluoro-1,2,3,4-tetrahydroquinolin-4-one,
4(1H)-Quinolinone, 7-fluoro-2,3-dihydro-,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.167g/mol |
| Monoisotopic Mass | 165.059g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number