| CAS Number | 2044713-23-5 |
| Catalog Number | AG01B6KO |
| Chemical Name | 1-(tert-Butoxycarbonyl)-2-(methoxymethyl)piperidine-2-carboxylic acid |
| IUPAC Name | 2-(methoxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid |
| InChI | InChI=1S/C13H23NO5/c1-12(2,3)19-11(17)14-8-6-5-7-13(14,9-18-4)10(15)16/h5-9H2,1-4H3,(H,15,16) |
| InChI Key | CSXPROMAXBDSHB-UHFFFAOYSA-N |
| MDL Number | MFCD30486631 |
| Molecular Formula | C13H23NO5 |
| Molecular Weight | 273.3254 |
| SMILES | O=C(C1(COC)N(C(OC(C)(C)C)=O)CCCC1)O |
| Synonyms | 1-[(tert-butoxy)carbonyl]-2-(methoxymethyl)piperidine-2-carboxylic acid,
2044713-23-5,
|
| Complexity | 349 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.329g/mol |
| Monoisotopic Mass | 273.158g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 76.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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