| CAS Number | 2137579-16-7 |
| Catalog Number | AG01EK99 |
| Chemical Name | 2-METHYL-5H,6H,7H,8H-[1,2,4]TRIAZOLO[1,5-A]PYRIDINE-6-CARBOXYLIC ACID HYDROCHLORIDE |
| IUPAC Name | 2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C8H11N3O2.ClH/c1-5-9-7-3-2-6(8(12)13)4-11(7)10-5;/h6H,2-4H2,1H3,(H,12,13);1H |
| InChI Key | SFSOUMJUEUXNHR-UHFFFAOYSA-N |
| MDL Number | MFCD31456776 |
| Molecular Formula | C8H12ClN3O2 |
| Molecular Weight | 217.6528 |
| SMILES | Cl.CC1=NN2C(CCC(C(O)=O)C2)=N1 |
| Synonyms | 2-methyl-5H,6H,7H,8H-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid hydrochloride,
2137579-16-7,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.653g/mol |
| Monoisotopic Mass | 217.062g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 68A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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