| CAS Number | 1909327-23-6 |
| Catalog Number | AG01C501 |
| Chemical Name | methyl({[1,2,4]triazolo[4,3-a]pyridin-3-yl}methyl)amine dihydrochloride |
| IUPAC Name | N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C8H10N4.2ClH/c1-9-6-8-11-10-7-4-2-3-5-12(7)8;;/h2-5,9H,6H2,1H3;2*1H |
| InChI Key | OHFDBOJARMKVFM-UHFFFAOYSA-N |
| MDL Number | MFCD29763252 |
| Molecular Formula | C8H12Cl2N4 |
| Molecular Weight | 235.1137 |
| SMILES | Cl.Cl.CNCC1N2C(C=CC=C2)=NN=1 |
| Synonyms | methyl({[1,2,4]triazolo[4,3-a]pyridin-3-yl}methyl)amine dihydrochloride,
1909327-23-6,
methyl({[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl})amine dihydrochloride,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.112g/mol |
| Monoisotopic Mass | 234.044g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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