| CAS Number | 852617-12-0 |
| Catalog Number | AG00G7QT(AGN-PC-0OJST0) |
| Chemical Name | 2,6-Di-(boc-amino)pyridine |
| IUPAC Name | tert-butyl N-[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-2-yl]carbamate |
| InChI | InChI=1S/C15H23N3O4/c1-14(2,3)21-12(19)17-10-8-7-9-11(16-10)18-13(20)22-15(4,5)6/h7-9H,1-6H3,(H2,16,17,18,19,20) |
| InChI Key | QVPCQNKHMFGPLW-UHFFFAOYSA-N |
| MDL Number | MFCD16621689 |
| Molecular Formula | C15H23N3O4 |
| Molecular Weight | 309.3608 |
| SMILES | O=C(NC1=CC=CC(NC(OC(C)(C)C)=O)=N1)OC(C)(C)C |
| Synonyms | 2,6-Di-(boc-amino)pyridine,
852617-12-0,
Di-tert-butyl pyridine-2,6-diyldicarbamate,
MFCD16621689,
ZINC98213404,
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| Complexity | 363 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 309.169g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 309.366g/mol |
| Monoisotopic Mass | 309.169g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 89.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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Certificate of Analysis
Lot Number