| CAS Number | 2007908-57-6 |
| Catalog Number | AG019EON |
| Chemical Name | N-(4-Fluorobenzyl)-2-oxopyrrolidine-3-carboxamide |
| IUPAC Name | N-[(4-fluorophenyl)methyl]-2-oxopyrrolidine-3-carboxamide |
| InChI | InChI=1S/C12H13FN2O2/c13-9-3-1-8(2-4-9)7-15-12(17)10-5-6-14-11(10)16/h1-4,10H,5-7H2,(H,14,16)(H,15,17) |
| InChI Key | RSRBCLNRYRLEKS-UHFFFAOYSA-N |
| MDL Number | MFCD30472064 |
| Molecular Formula | C12H13FN2O2 |
| Molecular Weight | 236.2422 |
| SMILES | Fc1ccc(CNC(=O)C2CCNC2=O)cc1 |
| Synonyms | N-(4-Fluorobenzyl)-2-oxopyrrolidine-3-carboxamide,
2007908-57-6,
MFCD30472064,
AKOS030628280,
CS-0038615,
|
| Complexity | 301 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.246g/mol |
| Monoisotopic Mass | 236.096g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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Certificate of Analysis
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