| CAS Number | 1384430-52-7 |
| Catalog Number | AG019Z53(AGN-PC-0WOWQ8) |
| Chemical Name | 2-(1-methyl-1H-1,2,4-triazol-3-yl)ethan-1-amine hydrochloride |
| IUPAC Name | 2-(1-methyl-1,2,4-triazol-3-yl)ethanamine;hydrochloride |
| InChI | InChI=1S/C5H10N4.ClH/c1-9-4-7-5(8-9)2-3-6;/h4H,2-3,6H2,1H3;1H |
| InChI Key | VOEFSWLIXXOWDF-UHFFFAOYSA-N |
| MDL Number | MFCD22369853 |
| Molecular Formula | C5H11ClN4 |
| Molecular Weight | 162.6206 |
| SMILES | Cl.CN1N=C(CCN)N=C1 |
| Synonyms | 2-(1-methyl-1H-1,2,4-triazol-3-yl)ethan-1-amine hydrochloride,
1384430-52-7,
2-(1-methyl-1H-1,2,4-triazol-3-yl)ethanamine hydrochloride,
AKOS026745355,
MCULE-2018345452,
NE44059,
Z1682072425,
2-(1-methyl-1,2,4-triazol-3-yl)ethanamine;hydrochloride,
|
| Complexity | 85 |
| 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 | 2 |
| Topological Polar Surface Area | 56.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number