| CAS Number | 1260769-17-2 |
| Catalog Number | AG000R6K(AGN-PC-0WACB8) |
| Chemical Name | 8-Bromo-6-methyl-[1,2,4]triazolo[4,3-a]pyridine |
| IUPAC Name | 8-bromo-6-methyl-[1,2,4]triazolo[4,3-a]pyridine |
| InChI | InChI=1S/C7H6BrN3/c1-5-2-6(8)7-10-9-4-11(7)3-5/h2-4H,1H3 |
| InChI Key | JLNJWYKFWODIMN-UHFFFAOYSA-N |
| MDL Number | MFCD11847254 |
| Molecular Formula | C3H9BO2 |
| Molecular Weight | 87.9134 |
| SMILES | OB(CCC)O |
| Synonyms | 1260769-17-2,
8-BROMO-6-METHYL-[1,2,4]TRIAZOLO[4,3-A]PYRIDINE,
ZINC82320078,
SC-31855,
Z9034,
K-1988,
8-Bromo-6-methyl[1,2,4]triazolo[4,3-a]pyridine,
1,2,4-Triazolo[4,3-a]pyridine, 8-bromo-6-methyl-,
C7H6BrN3,
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| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.975g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.05g/mol |
| Monoisotopic Mass | 210.975g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 30.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number