| CAS Number | 1204654-37-4 |
| Catalog Number | AG01B8TZ |
| Chemical Name | tert-butyl 2,5-dimethyl-4-oxopiperidine-1-carboxylate |
| IUPAC Name | tert-butyl 2,5-dimethyl-4-oxopiperidine-1-carboxylate |
| InChI | InChI=1S/C12H21NO3/c1-8-7-13(9(2)6-10(8)14)11(15)16-12(3,4)5/h8-9H,6-7H2,1-5H3 |
| InChI Key | AFMMHVFSLJYZKE-UHFFFAOYSA-N |
| MDL Number | MFCD14581711 |
| Molecular Formula | C12H21NO3 |
| Molecular Weight | 227.3000 |
| SMILES | CC1N(C(OC(C)(C)C)=O)CC(C)C(=O)C1 |
| Synonyms | tert-butyl 2,5-dimethyl-4-oxopiperidine-1-carboxylate,
1204654-37-4,
SCHEMBL6441115,
|
| Complexity | 293 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.304g/mol |
| Monoisotopic Mass | 227.152g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number