4-Phenyl-4H-1,2,4-triazole-3-thiol
4-phenyl-1H-1,2,4-triazole-5-thione
Also Known As: 4-Phenyl-4H-1,2,4-triazole-3-thiol|4-phenyl-1,2,4-triazole-3-thiol|4-phenyl-1H-1,2,4-triazole-5-thione|NCIOpen2_001479|4h-1,2,4-triazole-3-thiol, 4-phenyl-|4-Phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione|4-phenyl-2H-1,2,4-triazole-3-thione|4-phenyl-1,2,4-triazolin-5-thione|phenyl-4h-1,2,4-triazole-3-thione|4-phenyl-3-mercapto-1,2,4-triazole|SDCCGMLS-0064547.P001|BAS 00102001|4-Phenyl-1H-1,2,4-triazole-5(4H)-thione|4-Phenyl-2H-1,2,4-triazole-3(4H)-thione
| Molecular Formula | C8H7N3S |
|---|---|
| Molecular Weight | 177.03607 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.03607 |
| Monoisotopic Mass | 177.03607 |
| Heavy Atoms | 12 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 5397-92-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=NNC2=S |
| InChIKey | PUGUFBAPNSPHHY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Phenyl-4H-1,2,4-triazole-3-thiol (CAS 5397-92-2), with molecular formula C8H7N3S and molecular weight 177.03607 g/mol. IUPAC: 4-phenyl-1H-1,2,4-triazole-5-thione.
4-Phenyl-4H-1,2,4-triazole-3-thiol is a custom synthesis product. We offer services from milligram to kilogram scale.
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