| CAS Number | 1214902-64-3 |
| Catalog Number | AG01FR29(AGN-PC-3H5PE9) |
| Chemical Name | methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate |
| IUPAC Name | methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate |
| InChI | InChI=1S/C8H6BrN3O2/c1-14-7(13)5-3-2-4-6-10-8(9)11-12(5)6/h2-4H,1H3 |
| InChI Key | YBTXISNQOPMXFF-UHFFFAOYSA-N |
| MDL Number | MFCD27952306 |
| Molecular Formula | C8H6BrN3O2 |
| Molecular Weight | 256.0561 |
| SMILES | BrC1=NN2C(C=CC=C2C(=O)OC)=N1 |
| Synonyms | methyl 2-bromo-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate,
1214902-64-3,
SCHEMBL3297643,
YBTXISNQOPMXFF-UHFFFAOYSA-N,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.96434g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.06g/mol |
| Monoisotopic Mass | 254.96434g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 56.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number