| CAS Number | 1806963-70-1 |
| Catalog Number | AG01DYZY |
| Chemical Name | 4-amino-2-bromopyridine-3-carbonitrile |
| IUPAC Name | 4-amino-2-bromopyridine-3-carbonitrile |
| InChI | InChI=1S/C6H4BrN3/c7-6-4(3-8)5(9)1-2-10-6/h1-2H,(H2,9,10) |
| InChI Key | XHWJNDSBHZYJQQ-UHFFFAOYSA-N |
| MDL Number | MFCD24645415 |
| Molecular Formula | C6H4BrN3 |
| Molecular Weight | 198.0201 |
| SMILES | N#CC1=C(N)C=CN=C1Br |
| Synonyms | 4-Amino-2-bromonicotinonitrile,
1806963-70-1,
AKOS027291227,
4-AMINO-2-BROMOPYRIDINE-3-CARBONITRILE,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.959g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.023g/mol |
| Monoisotopic Mass | 196.959g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 62.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number