| CAS Number | 1803586-74-4 |
| Catalog Number | AG01ABPG(AGN-PC-0WO1NI) |
| Chemical Name | 1-Benzyl-1H-1,2,3-triazol-4-amine hydrochloride |
| IUPAC Name | 1-benzyltriazol-4-amine;hydrochloride |
| InChI | InChI=1S/C9H10N4.ClH/c10-9-7-13(12-11-9)6-8-4-2-1-3-5-8;/h1-5,7H,6,10H2;1H |
| InChI Key | UMCXRTLSNDOUAI-UHFFFAOYSA-N |
| MDL Number | MFCD27920035 |
| Molecular Formula | C9H11ClN4 |
| Molecular Weight | 210.6634 |
| SMILES | Cl.NC1N=NN(CC2=CC=CC=C2)C=1 |
| Synonyms | 1-benzyl-1H-1,2,3-triazol-4-amine hydrochloride,
1803586-74-4,
AKOS026726623,
NE28949,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.665g/mol |
| Monoisotopic Mass | 210.067g/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