| CAS Number | 1445951-27-8 |
| Catalog Number | AG00HX4L(AGN-PC-0WG4V7) |
| Chemical Name | Racemic-(2s,5s)-1-tert-butyl 2-ethyl 5-hydroxy-5-methylpiperidine-1,2-dicarboxylate |
| IUPAC Name | 1-O-tert-butyl 2-O-ethyl (2S,5S)-5-hydroxy-5-methylpiperidine-1,2-dicarboxylate |
| InChI | InChI=1S/C14H25NO5/c1-6-19-11(16)10-7-8-14(5,18)9-15(10)12(17)20-13(2,3)4/h10,18H,6-9H2,1-5H3/t10-,14-/m0/s1 |
| InChI Key | LCUOLVOVJYNKGX-HZMBPMFUSA-N |
| MDL Number | MFCD28390475 |
| Molecular Formula | C14H25NO5 |
| Molecular Weight | 287.3520 |
| SMILES | CCOC(=O)[C@@H]1CC[C@](C)(O)CN1C(=O)OC(C)(C)C |
| Synonyms | trans-1-tert-Butyl 2-ethyl 5-hydroxy-5-methylpiperidine-1,2-dicarboxylate,
1445951-27-8,
AKOS027429947,
CS-0036664,
(2S,5S)-1-tert-Butyl 2-ethyl 5-hydroxy-5-methylpiperidine-1,2-dicarboxylate,
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| Complexity | 376 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 287.173g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 287.356g/mol |
| Monoisotopic Mass | 287.173g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 76.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number