| CAS Number | 1955539-76-0 |
| Catalog Number | AG01B595 |
| Chemical Name | tert-butyl 8-oxo-5-azaspiro[3.4]octane-5-carboxylate |
| IUPAC Name | tert-butyl 8-oxo-5-azaspiro[3.4]octane-5-carboxylate |
| InChI | InChI=1S/C12H19NO3/c1-11(2,3)16-10(15)13-8-5-9(14)12(13)6-4-7-12/h4-8H2,1-3H3 |
| InChI Key | HELBTEOGDYXMOT-UHFFFAOYSA-N |
| MDL Number | MFCD29991974 |
| Molecular Formula | C12H19NO3 |
| Molecular Weight | 225.2842 |
| SMILES | O=C1CCN(C12CCC2)C(=O)OC(C)(C)C |
| Synonyms | tert-butyl 8-oxo-5-azaspiro[3.4]octane-5-carboxylate,
1955539-76-0,
AKOS033934082,
ZINC390822016,
Z2513333423,
|
| Complexity | 326 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.288g/mol |
| Monoisotopic Mass | 225.136g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number