| CAS Number | 2060052-70-0 |
| Catalog Number | AG01C04E |
| Chemical Name | 5-(aminomethyl)-N,N-dimethyl-4H-1,2,4-triazol-3-amine hydrochloride |
| IUPAC Name | 5-(aminomethyl)-N,N-dimethyl-1H-1,2,4-triazol-3-amine;hydrochloride |
| InChI | InChI=1S/C5H11N5.ClH/c1-10(2)5-7-4(3-6)8-9-5;/h3,6H2,1-2H3,(H,7,8,9);1H |
| InChI Key | GTXQKJRBLFMPDF-UHFFFAOYSA-N |
| MDL Number | MFCD30497821 |
| Molecular Formula | C5H12ClN5 |
| Molecular Weight | 177.6353 |
| SMILES | Cl.CN(C1NC(CN)=NN=1)C |
| Synonyms | 5-(aminomethyl)-N,N-dimethyl-4H-1,2,4-triazol-3-amine hydrochloride,
2060052-70-0,
Z2719323020,
|
| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.636g/mol |
| Monoisotopic Mass | 177.078g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 70.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number