| CAS Number | 19503-22-1 |
| Catalog Number | AG00ADCK(AGN-PC-09T7SX) |
| Chemical Name | 1H-Benzotriazole-1-carboxamidine Hydrochloride |
| IUPAC Name | benzotriazole-1-carboximidamide;hydrochloride |
| InChI | InChI=1S/C7H7N5.ClH/c8-7(9)12-6-4-2-1-3-5(6)10-11-12;/h1-4H,(H3,8,9);1H |
| InChI Key | OHOQRFDQABFISW-UHFFFAOYSA-N |
| MDL Number | MFCD18379189 |
| Molecular Formula | C7H8ClN5 |
| Molecular Weight | 197.6249 |
| SMILES | Cl.N1(N=NC2=C1C=CC=C2)C(N)=N |
| Synonyms | 1H-BENZOTRIAZOLE-1-CARBOXAMIDINE HYDROCHLORIDE,
19503-22-1,
SCHEMBL2681010,
DTXSID60700716,
OHOQRFDQABFISW-UHFFFAOYSA-N,
1-guanyl-benzotriazole hydrochloride,
FT-0662585,
1H-Benzotriazole-1-carboxamidine Monohydrochloride,
J-012632,
1H-1,2,3-Benzotriazole-1-carboximidamide hydrochloride,
1H-benzo[d][1,2,3]triazole-1-carboximidamide HCl salt,
1H-Benzotriazole-1-carboximidamide--hydrogen chloride (1/1),
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.626g/mol |
| Monoisotopic Mass | 197.047g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number