| CAS Number | 1789455-92-0 |
| Catalog Number | AG01AM6B |
| Chemical Name | 5-amino-N-cyclopropyl-1H-1,2,3-triazole-4-carboxamide |
| IUPAC Name | 5-amino-N-cyclopropyl-2H-triazole-4-carboxamide |
| InChI | InChI=1S/C6H9N5O/c7-5-4(9-11-10-5)6(12)8-3-1-2-3/h3H,1-2H2,(H,8,12)(H3,7,9,10,11) |
| InChI Key | CPCKKMGSXQLFEC-UHFFFAOYSA-N |
| MDL Number | MFCD28968379 |
| Molecular Formula | C6H9N5O |
| Molecular Weight | 167.1686 |
| SMILES | NC1=C(C(NC2CC2)=O)N=NN1 |
| Synonyms | 1789455-92-0,
5-amino-N-cyclopropyl-1H-1,2,3-triazole-4-carboxamide,
AKOS027808354,
ZINC169821855,
Z2216303115,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.172g/mol |
| Monoisotopic Mass | 167.081g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 96.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number