| CAS Number | 1216292-05-5 |
| Catalog Number | AG0015FL(AGN-PC-0WBKMN) |
| Chemical Name | 6-Bromo-[1,2,4]triazolo[4,3-a]pyridin-8-amine |
| IUPAC Name | 6-bromo-[1,2,4]triazolo[4,3-a]pyridin-8-amine |
| InChI | InChI=1S/C6H5BrN4/c7-4-1-5(8)6-10-9-3-11(6)2-4/h1-3H,8H2 |
| InChI Key | DXDYQEVFUVHKQP-UHFFFAOYSA-N |
| MDL Number | MFCD14545816 |
| Molecular Formula | C6H5BrN4 |
| Molecular Weight | 213.0347 |
| SMILES | Brc1cc(N)c2n(c1)cnn2 |
| Synonyms | 6-bromo-[1,2,4]triazolo[4,3-a]pyridin-8-amine,
1216292-05-5,
SCHEMBL17875666,
KM3677,
MFCD14545816,
ZINC36242501,
AKOS015948609,
MCULE-4450598509,
CJ-18878,
Z8426,
1,2,4-Triazolo[4,3-a]pyridin-8-amine, 6-bromo-,
C6H5BrN4,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.038g/mol |
| Monoisotopic Mass | 211.97g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 56.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number