| CAS Number | 1257046-70-0 |
| Catalog Number | AG00HIFM(AGN-PC-0WR25R) |
| Chemical Name | 3-(Boc-aminomethyl)-1-acetylpiperidine |
| IUPAC Name | tert-butyl N-[(1-acetylpiperidin-3-yl)methyl]carbamate |
| InChI | InChI=1S/C13H24N2O3/c1-10(16)15-7-5-6-11(9-15)8-14-12(17)18-13(2,3)4/h11H,5-9H2,1-4H3,(H,14,17) |
| InChI Key | YADXXXMWCCGNFJ-UHFFFAOYSA-N |
| MDL Number | MFCD28359543 |
| Molecular Formula | C13H24N2O3 |
| Molecular Weight | 256.3413 |
| SMILES | CC(=O)N1CCCC(CNC(=O)OC(C)(C)C)C1 |
| Synonyms | 1257046-70-0,
3-(Boc-aminomethyl)-1-acetylpiperidine,
tert-Butyl ((1-acetylpiperidin-3-yl)methyl)carbamate,
MFCD28359543,
tert-butyl (1-acetylpiperidin-3-yl)methylcarbamate,
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| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.346g/mol |
| Monoisotopic Mass | 256.179g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number