| CAS Number | 1000933-23-2 |
| Catalog Number | AG019LIZ(AGN-PC-0WO4FN) |
| Chemical Name | 5-amino-4-cyclopropyl-4H-1,2,4-triazole-3-thiol |
| IUPAC Name | 3-amino-4-cyclopropyl-1H-1,2,4-triazole-5-thione |
| InChI | InChI=1S/C5H8N4S/c6-4-7-8-5(10)9(4)3-1-2-3/h3H,1-2H2,(H2,6,7)(H,8,10) |
| InChI Key | AYGLNHBCKFNEAF-UHFFFAOYSA-N |
| MDL Number | MFCD09971480 |
| Molecular Formula | C5H8N4S |
| Molecular Weight | 156.2088 |
| SMILES | NC1N(C2CC2)C(S)=NN=1 |
| Synonyms | 5-amino-4-cyclopropyl-4H-1,2,4-triazole-3-thiol,
1000933-23-2,
AC1Q535R,
CTK7E1424,
CTK8F6721,
ZINC12896230,
AKOS009171297,
MCULE-4287929728,
NE23471,
EN300-31398,
Z335451426,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.207g/mol |
| Monoisotopic Mass | 156.047g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 85.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number