| CAS Number | 1798008-00-0 |
| Catalog Number | AG01BCS7(AGN-PC-0WOSVS) |
| Chemical Name | 1-(1-methyl-1H-1,2,4-triazol-5-yl)ethan-1-amine hydrochloride |
| IUPAC Name | 1-(2-methyl-1,2,4-triazol-3-yl)ethanamine;hydrochloride |
| InChI | InChI=1S/C5H10N4.ClH/c1-4(6)5-7-3-8-9(5)2;/h3-4H,6H2,1-2H3;1H |
| InChI Key | DLIXLNZZIKSYMA-UHFFFAOYSA-N |
| MDL Number | MFCD28012296 |
| Molecular Formula | C5H11ClN4 |
| Molecular Weight | 162.6206 |
| SMILES | Cl.CC(C1N(C)N=CN=1)N |
| Synonyms | 1-(1-methyl-1H-1,2,4-triazol-5-yl)ethan-1-amine hydrochloride,
1798008-00-0,
AKOS026742745,
MCULE-9910911454,
Z1824511251,
|
| Complexity | 95 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 162.621g/mol |
| Monoisotopic Mass | 162.067g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 56.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number