| CAS Number | 1188964-92-2 |
| Catalog Number | AG0094CI(AGN-PC-0WAEM7) |
| Chemical Name | N-Methyl (4-BOC-piperazino)acetamide |
| IUPAC Name | tert-butyl 4-[2-(methylamino)-2-oxoethyl]piperazine-1-carboxylate |
| InChI | InChI=1S/C12H23N3O3/c1-12(2,3)18-11(17)15-7-5-14(6-8-15)9-10(16)13-4/h5-9H2,1-4H3,(H,13,16) |
| InChI Key | SKWKZGHYQAZMGG-UHFFFAOYSA-N |
| MDL Number | MFCD14857038 |
| Molecular Formula | C12H23N3O3 |
| Molecular Weight | 257.3293 |
| SMILES | CNC(=O)CN1CCN(CC1)C(=O)OC(C)(C)C |
| Synonyms | N-Methyl (4-BOC-piperazino)acetamide,
1188964-92-2,
C12H23N3O3,
tert-butyl 4-[2-(methylamino)-2-oxoethyl]piperazine-1-carboxylate,
SCHEMBL17271431,
STL089987,
ZINC44791124,
AKOS005647010,
MCULE-2579671045,
Z8051,
K-1342,
TERT-BUTYL 4-[(METHYLCARBAMOYL)METHYL]PIPERAZINE-1-CARBOXYLATE,
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| Complexity | 304 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.174g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.334g/mol |
| Monoisotopic Mass | 257.174g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 61.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number