| CAS Number | 1155000-06-8 |
| Catalog Number | AG019UEC(AGN-PC-0WO0YE) |
| Chemical Name | 6-Amino-7-fluoro-1,2,3,4-tetrahydroquinolin-2-one |
| IUPAC Name | 6-amino-7-fluoro-3,4-dihydro-1H-quinolin-2-one |
| InChI | InChI=1S/C9H9FN2O/c10-6-4-8-5(3-7(6)11)1-2-9(13)12-8/h3-4H,1-2,11H2,(H,12,13) |
| InChI Key | UGMNWHDIBDUYRC-UHFFFAOYSA-N |
| MDL Number | MFCD12173926 |
| Molecular Formula | C9H9FN2O |
| Molecular Weight | 180.1790 |
| SMILES | NC=1C=C2CCC(NC2=CC1F)=O |
| Synonyms | 6-amino-7-fluoro-1,2,3,4-tetrahydroquinolin-2-one,
1155000-06-8,
ZINC35348145,
AKOS009471306,
NE18680,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.182g/mol |
| Monoisotopic Mass | 180.07g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number