| CAS Number | 1267341-14-9 |
| Catalog Number | AG01A1YV(AGN-PC-0WO4YM) |
| Chemical Name | tert-Butyl 4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxylate |
| InChI | InChI=1S/C13H26N2O3/c1-12(2,3)18-11(16)15-8-6-14(7-9-15)10-13(4,5)17/h17H,6-10H2,1-5H3 |
| InChI Key | KAYYHDGKDUBNON-UHFFFAOYSA-N |
| MDL Number | MFCD19330916 |
| Molecular Formula | C13H26N2O3 |
| Molecular Weight | 258.3571 |
| SMILES | OC(CN1CCN(CC1)C(=O)OC(C)(C)C)(C)C |
| Synonyms | tert-butyl 4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxylate,
1267341-14-9,
SCHEMBL1087319,
KAYYHDGKDUBNON-UHFFFAOYSA-N,
ZINC49847275,
AKOS013214510,
MCULE-1917070605,
NE33236,
Z1171458127,
|
| Complexity | 289 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.362g/mol |
| Monoisotopic Mass | 258.194g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 53A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number