| CAS Number | 1214902-65-4 |
| Catalog Number | AG01FR2I(AGN-PC-3H5PEE) |
| Chemical Name | 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid |
| IUPAC Name | 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid |
| InChI | InChI=1S/C7H4BrN3O2/c8-7-9-5-3-1-2-4(6(12)13)11(5)10-7/h1-3H,(H,12,13) |
| InChI Key | RYIYWYJKBZXUBW-UHFFFAOYSA-N |
| MDL Number | MFCD27937938 |
| Molecular Formula | C7H4BrN3O2 |
| Molecular Weight | 242.0296 |
| SMILES | Brc1nn2c(n1)cccc2C(=O)O |
| Synonyms | 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid,
1214902-65-4,
SCHEMBL3299884,
RYIYWYJKBZXUBW-UHFFFAOYSA-N,
|
| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.94869g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.03g/mol |
| Monoisotopic Mass | 240.94869g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number