| CAS Number | 1795232-59-5 |
| Catalog Number | AG00IL0W(AGN-PC-0WG3I7) |
| Chemical Name | Methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate |
| IUPAC Name | methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate |
| InChI | InChI=1S/C8H6BrN3O2/c1-14-7(13)5-2-3-6-10-8(9)11-12(6)4-5/h2-4H,1H3 |
| InChI Key | HRKNVEBXWJDVFK-UHFFFAOYSA-N |
| MDL Number | MFCD26131656 |
| Molecular Formula | C8H6BrN3O2 |
| Molecular Weight | 256.0561 |
| SMILES | COC(=O)C1=CN2N=C(Br)N=C2C=C1 |
| Synonyms | Methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate,
1795232-59-5,
SCHEMBL16781951,
HRKNVEBXWJDVFK-UHFFFAOYSA-N,
AKOS027427559,
CS-0049178,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.059g/mol |
| Monoisotopic Mass | 254.964g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 56.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number