| CAS Number | 69879-20-5 |
| Catalog Number | AG01C6JG |
| Chemical Name | Tert-butyl 6-aminopyridine-3-carboxylate |
| IUPAC Name | tert-butyl 6-aminopyridine-3-carboxylate |
| InChI | InChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)7-4-5-8(11)12-6-7/h4-6H,1-3H3,(H2,11,12) |
| InChI Key | HDKKGUCSENOBHD-UHFFFAOYSA-N |
| MDL Number | MFCD18304499 |
| Molecular Formula | C10H14N2O2 |
| Molecular Weight | 194.2304 |
| SMILES | CC(OC(C1=CN=C(N)C=C1)=O)(C)C |
| Synonyms | tert-Butyl 6-aminonicotinate,
tert-butyl 6-aminopyridine-3-carboxylate,
69879-20-5,
SCHEMBL623715,
HDKKGUCSENOBHD-UHFFFAOYSA-N,
ZINC63216589,
AKOS012563102,
6-Aminonicotinic acid tert-butyl ester,
DA-41657,
FT-0743667,
6-aminopyridine-3-carboxylic acid tert-butyl ester,
F2147-2094,
Z2492774575,
3-Pyridinecarboxylic acid, 6-amino-, 1,1-dimethylethyl ester,
|
| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.234g/mol |
| Monoisotopic Mass | 194.106g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 65.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number