| CAS Number | 1936555-43-9 |
| Catalog Number | AG01C3HG |
| Chemical Name | tert-butyl 2,3,5-trimethylpiperazine-1-carboxylate |
| IUPAC Name | tert-butyl 2,3,5-trimethylpiperazine-1-carboxylate |
| InChI | InChI=1S/C12H24N2O2/c1-8-7-14(10(3)9(2)13-8)11(15)16-12(4,5)6/h8-10,13H,7H2,1-6H3 |
| InChI Key | IPQYEIDFNYVNKF-UHFFFAOYSA-N |
| MDL Number | MFCD29991280 |
| Molecular Formula | C12H24N2O2 |
| Molecular Weight | 228.3312 |
| SMILES | CC1NC(C)C(C)N(C(OC(C)(C)C)=O)C1 |
| Synonyms | 1936555-43-9,
tert-butyl 2,3,5-trimethylpiperazine-1-carboxylate,
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.184g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.336g/mol |
| Monoisotopic Mass | 228.184g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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