| CAS Number | 1057650-80-2 |
| Catalog Number | AG01C1CC |
| Chemical Name | Tert-Butyl N-[(2-Aminopyridin-3-Yl)Methyl]Carbamate |
| IUPAC Name | tert-butyl N-[(2-aminopyridin-3-yl)methyl]carbamate |
| InChI | InChI=1S/C11H17N3O2/c1-11(2,3)16-10(15)14-7-8-5-4-6-13-9(8)12/h4-6H,7H2,1-3H3,(H2,12,13)(H,14,15) |
| InChI Key | QUMFUXVPWYOXRX-UHFFFAOYSA-N |
| MDL Number | MFCD16293635 |
| Molecular Formula | C11H17N3O2 |
| Molecular Weight | 223.2716 |
| SMILES | NC1=NC=CC=C1CNC(OC(C)(C)C)=O |
| Synonyms | 1057650-80-2,
tert-butyl N-[(2-aminopyridin-3-yl)methyl]carbamate,
tert-butyl [(2-aminopyridin-3-yl)methyl]carbamate,
AKOS033383975,
ZINC238177963,
Z1505702608,
tert-Butyl (2-amino-3-pyridinyl)methylcarbamate, AldrichCPR,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.276g/mol |
| Monoisotopic Mass | 223.132g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 77.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number