| CAS Number | 1798843-57-8 |
| Catalog Number | AG01EKYG |
| Chemical Name | 1-(tert-Butoxycarbonyl)-4,4-dimethylpiperidine-3-carboxylic acid |
| IUPAC Name | 4,4-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid |
| InChI | InChI=1S/C13H23NO4/c1-12(2,3)18-11(17)14-7-6-13(4,5)9(8-14)10(15)16/h9H,6-8H2,1-5H3,(H,15,16) |
| InChI Key | GLMLDEYDJXVCHC-UHFFFAOYSA-N |
| MDL Number | MFCD31629285 |
| Molecular Formula | C13H23NO4 |
| Molecular Weight | 257.3260 |
| SMILES | C(C)(C)(C)OC(=O)N1CC(C(CC1)(C)C)C(=O)O |
| Synonyms | AKOS034130795,
1-[(tert-butoxy)carbonyl]-4,4-dimethylpiperidine-3-carboxylic acid,
1798843-57-8,
|
| Complexity | 343 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.33g/mol |
| Monoisotopic Mass | 257.163g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number