| CAS Number | 1007207-76-2 |
| Catalog Number | AG0002P9(AGN-PC-0WRAED) |
| Chemical Name | N-tert-Butyl-4-chloropyridine-2-carboxamide |
| IUPAC Name | N-tert-butyl-4-chloropyridine-2-carboxamide |
| InChI | InChI=1S/C10H13ClN2O/c1-10(2,3)13-9(14)8-6-7(11)4-5-12-8/h4-6H,1-3H3,(H,13,14) |
| InChI Key | NTBJAFUDHLARIW-UHFFFAOYSA-N |
| MDL Number | MFCD11102507 |
| Molecular Formula | C10H13ClN2O |
| Molecular Weight | 212.6760 |
| SMILES | O=C(C1=NC=CC(Cl)=C1)NC(C)(C)C |
| Synonyms | N-tert-Butyl-4-chloropyridine-2-carboxamide,
1007207-76-2,
N-(tert-Butyl)-4-chloropicolinamide,
ACMC-2097s4,
SCHEMBL2378723,
CTK8A8984,
DTXSID90647706,
NTBJAFUDHLARIW-UHFFFAOYSA-N,
4-chloropicolinic acid t-butylamide,
ANW-14354,
ZINC34937661,
AKOS008981635,
TC-103099,
Z6307,
2-Pyridinecarboxamide, 4-chloro-N-(1,1-dimethylethyl)-,
C10H13ClN2O,
4-chloro-N-(tert-butyl)pyridine-2-carboxamide,
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| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.677g/mol |
| Monoisotopic Mass | 212.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number