| CAS Number | 1400645-41-1 |
| Catalog Number | AG001BZ1(AGN-PC-0WNNHL) |
| Chemical Name | 2-Pyridinecarboxamide, 5-bromo-3-methyl- |
| IUPAC Name | 5-bromo-3-methylpyridine-2-carboxamide |
| InChI | InChI=1S/C7H7BrN2O/c1-4-2-5(8)3-10-6(4)7(9)11/h2-3H,1H3,(H2,9,11) |
| InChI Key | MKNANAVYPACJGZ-UHFFFAOYSA-N |
| MDL Number | MFCD22421549 |
| Molecular Formula | C7H7BrN2O |
| Molecular Weight | 215.0473 |
| SMILES | O=C(C1=NC=C(Br)C=C1C)N |
| Synonyms | 5-bromo-3-methylpyridine-2-carboxamide,
1400645-41-1,
5-Bromo-3-methylpicolinamide,
2-Pyridinecarboxamide, 5-bromo-3-methyl-,
SCHEMBL3129841,
MKNANAVYPACJGZ-UHFFFAOYSA-N,
KM5540,
MFCD22421549,
ZINC95495969,
AKOS025403595,
FCH2260937,
CJ-22705,
AX8300024,
FT-0764395,
V3028,
5-Bromo-3-methyl-pyridine-2-carboxylic acid amide,
C7H7BrN2O,
5-bromo-3-methyl-2-Pyridinecarboxamide,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.05g/mol |
| Monoisotopic Mass | 213.974g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 56A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number