| CAS Number | 1433965-43-5 |
| Catalog Number | AG01DW1R |
| Chemical Name | 2-bromo-N,N-dimethylpyridine-3-carboxamide |
| IUPAC Name | 2-bromo-N,N-dimethylpyridine-3-carboxamide |
| InChI | InChI=1S/C8H9BrN2O/c1-11(2)8(12)6-4-3-5-10-7(6)9/h3-5H,1-2H3 |
| InChI Key | XLLFOYLOXZNGKU-UHFFFAOYSA-N |
| MDL Number | MFCD28154508 |
| Molecular Formula | C8H9BrN2O |
| Molecular Weight | 229.0739 |
| SMILES | BrC1=NC=CC=C1C(=O)N(C)C |
| Synonyms | 2-Bromo-N,N-dimethylnicotinamide,
1433965-43-5,
3-Pyridinecarboxamide, 2-bromo-N,N-dimethyl-,
SCHEMBL16086240,
XLLFOYLOXZNGKU-UHFFFAOYSA-N,
AKOS026739241,
ZINC134339996,
2-bromo-N,N-dimethylpyridine-3-carboxamide,
N/A,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.077g/mol |
| Monoisotopic Mass | 227.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number