| CAS Number | 1803601-43-5 |
| Catalog Number | AG01BC2B |
| Chemical Name | (1-methyl-1H-1,2,4-triazol-5-yl)methanol hydrobromide |
| IUPAC Name | (2-methyl-1,2,4-triazol-3-yl)methanol;hydrobromide |
| InChI | InChI=1S/C4H7N3O.BrH/c1-7-4(2-8)5-3-6-7;/h3,8H,2H2,1H3;1H |
| InChI Key | HFVNIULSFDHTIO-UHFFFAOYSA-N |
| MDL Number | MFCD28714683 |
| Molecular Formula | C4H8BrN3O |
| Molecular Weight | 194.0298 |
| SMILES | Br.CN1C(CO)=NC=N1 |
| Synonyms | (1-methyl-1H-1,2,4-triazol-5-yl)methanol hydrobromide,
1803601-43-5,
|
| Complexity | 77.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.032g/mol |
| Monoisotopic Mass | 192.985g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Lot Number