| CAS Number | 405087-74-3 |
| Catalog Number | AG00CB3E(AGN-PC-09T0UU) |
| Chemical Name | 3-(2-Oxiranyl)-1-piperidinecarboxylic acid 1,1-dimethylethylester |
| IUPAC Name | tert-butyl 3-(oxiran-2-yl)piperidine-1-carboxylate |
| InChI | InChI=1S/C12H21NO3/c1-12(2,3)16-11(14)13-6-4-5-9(7-13)10-8-15-10/h9-10H,4-8H2,1-3H3 |
| InChI Key | YIKGDITZMFUCDL-UHFFFAOYSA-N |
| MDL Number | MFCD11656421 |
| Molecular Formula | C12H21NO3 |
| Molecular Weight | 227.3000 |
| SMILES | O=C(N1CC(C2OC2)CCC1)OC(C)(C)C |
| Synonyms | 405087-74-3,
3-(2-OXIRANYL)-1-PIPERIDINECARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER,
tert-Butyl 3-(oxiran-2-yl)piperidine-1-carboxylate,
3-(2-Oxiranyl)-1-piperidinecarboxylic acid 1,1-dimethylethylester,
SCHEMBL13106844,
CTK4I3231,
DTXSID00698724,
FCH1628362,
ACM405087743,
DB-082316,
FT-0748199,
3- -1-piperidinecarboxylicacid1,1-dimethylethylester,
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| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.304g/mol |
| Monoisotopic Mass | 227.152g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 42.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number