4-Methyl-5-phenyl-4H-1,2,4-triazole-3-thiol
Catalog No: FT-0678569
CAS No: 38942-51-7
- Chemical Name: 4-Methyl-5-phenyl-4H-1,2,4-triazole-3-thiol
- Molecular Formula: C9H9N3S
- Molecular Weight: 191.26 g/mol
- InChI Key: XGLHJEZLNGXEAZ-UHFFFAOYSA-N
- InChI: InChI=1S/C9H9N3S/c1-12-8(10-11-9(12)13)7-5-3-2-4-6-7/h2-6H,1H3,(H,11,13)
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Product_Name: | 4-methyl-3-phenyl-1H-1,2,4-triazole-5-thione |
|---|---|
| Flash_Point: | 117.1ºC |
| Melting_Point: | N/A |
| FW: | 191.25300 |
| Density: | 1.28g/cm3 |
| CAS: | 38942-51-7 |
| Bolling_Point: | 270.1ºC at 760mmHg |
| MF: | C9H9N3S |
| Density: | 1.28g/cm3 |
|---|---|
| Computational_Chemistry: | ['1. XlogP :16 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :2 ', '6. TPSA :597 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :243 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| LogP: | 2.14470 |
| Flash_Point: | 117.1ºC |
| Refractive_Index: | 1.68 |
| FW: | 191.25300 |
| PSA: | 65.70000 |
| MF: | C9H9N3S |
| Bolling_Point: | 270.1ºC at 760mmHg |
| Exact_Mass: | 191.05200 |
| HS_Code: | 2933990090 |
|---|
