| CAS Number | 953741-07-6 |
| Catalog Number | AG019WS6(AGN-PC-0WO7V8) |
| Chemical Name | 1-(3-Amino-4-fluorophenyl)pyrrolidine-2,5-dione |
| IUPAC Name | 1-(3-amino-4-fluorophenyl)pyrrolidine-2,5-dione |
| InChI | InChI=1S/C10H9FN2O2/c11-7-2-1-6(5-8(7)12)13-9(14)3-4-10(13)15/h1-2,5H,3-4,12H2 |
| InChI Key | YCZCNWWMOUAKFV-UHFFFAOYSA-N |
| MDL Number | MFCD09735900 |
| Molecular Formula | C10H9FN2O2 |
| Molecular Weight | 208.1891 |
| SMILES | NC1=C(F)C=CC(N2C(=O)CCC2=O)=C1 |
| Synonyms | 1-(3-amino-4-fluorophenyl)pyrrolidine-2,5-dione,
953741-07-6,
CTK7H3230,
AC1Q5121,
ZINC22214166,
AKOS000144085,
NE58078,
EN300-52988,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.192g/mol |
| Monoisotopic Mass | 208.065g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
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Certificate of Analysis
Lot Number