| CAS Number | 2044704-95-0 |
| Catalog Number | AG0029II(AGN-PC-0WNH8N) |
| Chemical Name | 4-Piperidinecarboxylic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidine-4-carboxylate |
| InChI | InChI=1S/C15H28N2O4/c1-13(2,3)20-11(18)15(7-9-16-10-8-15)17-12(19)21-14(4,5)6/h16H,7-10H2,1-6H3,(H,17,19) |
| InChI Key | PPNHBFSESHCUKS-UHFFFAOYSA-N |
| MDL Number | MFCD30489101 |
| Molecular Formula | C15H28N2O4 |
| Molecular Weight | 300.3938 |
| SMILES | C(=O)(OC(C)(C)C)C1(NC(=O)OC(C)(C)C)CCNCC1 |
| Synonyms | 2044704-95-0,
tert-butyl 4-{[(tert-butoxy)carbonyl]amino}piperidine-4-carboxylate,
tert-Butyl 4-((tert-butoxycarbonyl)amino)piperidine-4-carboxylate,
tert-Butyl 4-([(tert-butoxy)carbonyl]amino)piperidine-4-carboxylate,
MFCD30489101,
AKOS030527482,
ZINC397101730,
KS-000008R9,
AS-54045,
CS-0048236,
t-Butyl 4-{[(tert-butoxy)carbonyl]aminopiperidine-4-carboxylate,
tert-butyl 4-{[(tert-butoxy)carbonyl]aminopiperidine-4-carboxylate,
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| Complexity | 388 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 300.205g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 300.399g/mol |
| Monoisotopic Mass | 300.205g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 76.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number