![1-[[2,4,6-Tris(isopropyl)phenyl]sulphonyl]-1H-1,2,4-triazole (CAS: 54230-60-3) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0605477.png "1-[[2,4,6-Tris(isopropyl)phenyl]sulphonyl]-1H-1,2,4-triazole chemical structure")
1-[[2,4,6-Tris(isopropyl)phenyl]sulphonyl]-1H-1,2,4-triazole
Catalog No: FT-0605477
CAS No: 54230-60-3
- Chemical Name: 1-[[2,4,6-Tris(isopropyl)phenyl]sulphonyl]-1H-1,2,4-triazole
- Molecular Formula: C17H25N3O2S
- Molecular Weight: 335.5
- InChI Key: BKJMMUUBRUWPPQ-UHFFFAOYSA-N
- InChI: InChI=1S/C17H25N3O2S/c1-11(2)14-7-15(12(3)4)17(16(8-14)13(5)6)23(21,22)20-10-18-9-19-20/h7-13H,1-6H3
| 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 |
| Bolling_Point: | 451.9±55.0 °C at 760 mmHg |
|---|---|
| MF: | C17H25N3O2S |
| Density: | 1.2±0.1 g/cm3 |
| FW: | 335.464 |
| Product_Name: | 1-[[2,4,6-Tris(Isopropyl)Phenyl]Sulphonyl]-1H-1,2,4-Triazole |
| CAS: | 54230-60-3 |
| Flash_Point: | 227.1±31.5 °C |
| Melting_Point: | 111-114 °C |
| Bolling_Point: | 451.9±55.0 °C at 760 mmHg |
|---|---|
| Vapor_Pressure: | 0.0±1.1 mmHg at 25°C |
| LogP: | 4.30 |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density（g/mL,25ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1） Unknow ', '4 . Melting point（ºC）111-114 ', '5 . Boiling point（ºC）Unknow ', '6 . Boiling point（ºC，10mm hg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（°F）Unknow ', '9 . Specific rotation（ºC）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC） Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow'] |
| Computational_Chemistry: | ['1. XlogP :46 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 732 ', '7. Heavy Atom Count :23 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :467 ', '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'] |
| Melting_Point: | 111-114 °C |
| Exact_Mass: | 335.166748 |
| MF: | C17H25N3O2S |
| Density: | 1.2±0.1 g/cm3 |
| Refractive_Index: | 1.579 |
| PSA: | 73.23000 |
| Flash_Point: | 227.1±31.5 °C |
| FW: | 335.464 |
| Safety_Statements: | S26-S36 |
|---|---|
| HS_Code: | 2933990090 |
| WGK_Germany: | 3 |
| Hazard_Codes: | Xi |
| Risk_Statements(EU): | R36/37/38 |
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