| CAS Number | 144084-35-5 |
| Catalog Number | AG001IVN(AGN-PC-0MX9PT) |
| Chemical Name | N-t-Butyl-2-methoxynicotinamide |
| IUPAC Name | N-tert-butyl-2-methoxypyridine-3-carboxamide |
| InChI | InChI=1S/C11H16N2O2/c1-11(2,3)13-9(14)8-6-5-7-12-10(8)15-4/h5-7H,1-4H3,(H,13,14) |
| InChI Key | KEOPBHKTPCLLJC-UHFFFAOYSA-N |
| MDL Number | MFCD13195783 |
| Molecular Formula | C11H16N2O2 |
| Molecular Weight | 208.2569 |
| SMILES | COc1ncccc1C(=O)NC(C)(C)C |
| Synonyms | N-T-BUTYL-2-METHOXYNICOTINAMIDE,
144084-35-5,
N-tert-butyl-2-methoxynicotinamide,
CTK4C3925,
DTXSID90435680,
ANW-20831,
MFCD13195783,
ZINC34076827,
AKOS009160386,
TR-035716,
K-4621,
3-Pyridinecarboxamide, N-(1,1-dimethylethyl)-2-methoxy-,
CID10104850,
2-methoxy-N-tert-butyl-pyridine-3-carboxamide,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.261g/mol |
| Monoisotopic Mass | 208.121g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number