| CAS Number | 1266119-48-5 |
| Catalog Number | AG00HRIY(AGN-PC-0WQVLL) |
| Chemical Name | tert-Butyl N-(4-aminopyridin-2-yl)carbamate |
| IUPAC Name | tert-butyl N-(4-aminopyridin-2-yl)carbamate |
| InChI | InChI=1S/C10H15N3O2/c1-10(2,3)15-9(14)13-8-6-7(11)4-5-12-8/h4-6H,1-3H3,(H3,11,12,13,14) |
| InChI Key | VCKIIOUFGULFEC-UHFFFAOYSA-N |
| MDL Number | MFCD18447568 |
| Molecular Formula | C10H15N3O2 |
| Molecular Weight | 209.2450 |
| SMILES | CC(C)(C)OC(=O)Nc1cc(ccn1)N |
| Synonyms | tert-butyl N-(4-aminopyridin-2-yl)carbamate,
1266119-48-5,
4-Amino-2-(Boc-amino)pyridine,
tert-Butyl (4-aminopyridin-2-yl)carbamate,
SCHEMBL7909650,
MFCD18447568,
ZINC145240462,
CS-0037770,
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| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.249g/mol |
| Monoisotopic Mass | 209.116g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 77.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
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