| CAS Number | 1303974-24-4 |
| Catalog Number | AG00HS1G(AGN-PC-0WQXP8) |
| Chemical Name | 1-tert-Butyl 3-ethyl 5-oxopiperidine-1,3-dicarboxylate |
| IUPAC Name | 1-O-tert-butyl 3-O-ethyl 5-oxopiperidine-1,3-dicarboxylate |
| InChI | InChI=1S/C13H21NO5/c1-5-18-11(16)9-6-10(15)8-14(7-9)12(17)19-13(2,3)4/h9H,5-8H2,1-4H3 |
| InChI Key | RIOIEBYUBPFLOY-UHFFFAOYSA-N |
| MDL Number | MFCD18909957 |
| Molecular Formula | C13H21NO5 |
| Molecular Weight | 271.3095 |
| SMILES | O(C(C)(C)C)C(N1CC(CC(C(=O)OCC)C1)=O)=O |
| Synonyms | 1-TERT-BUTYL 3-ETHYL 5-OXOPIPERIDINE-1,3-DICARBOXYLATE,
1303974-24-4,
MFCD18909957,
AS-39112,
|
| Complexity | 372 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.313g/mol |
| Monoisotopic Mass | 271.142g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 72.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number