| CAS Number | 1367824-76-7 |
| Catalog Number | AG01BUWB |
| Chemical Name | 8-Bromo-[1,2,4]triazolo[1,5-a]pyrazine |
| IUPAC Name | 8-bromo-[1,2,4]triazolo[1,5-a]pyrazine |
| InChI | InChI=1S/C5H3BrN4/c6-4-5-8-3-9-10(5)2-1-7-4/h1-3H |
| InChI Key | KCKXFKKYHUURSX-UHFFFAOYSA-N |
| MDL Number | MFCD22059055 |
| Molecular Formula | C5H3BrN4 |
| Molecular Weight | 199.0081 |
| SMILES | Brc1nccn2c1ncn2 |
| Synonyms | 8-Bromo-[1,2,4]triazolo[1,5-a]pyrazine,
1367824-76-7,
MFCD22059055,
ZINC82384069,
FCH1585168,
AK431058,
DS-18742,
AX8267527,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.011g/mol |
| Monoisotopic Mass | 197.954g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number