2,4,6-TRIMETHYLBENZYL MERCAPTAN
Catalog No: FT-0609905
CAS No: 21411-42-7
- Molecular Formula: 166.29
- Formula Weight: C10H14S
- Inchl Key: LJZYEPXPMRRXTA-UHFFFAOYSA-N
- Inchl: InChI=1S/C10H14S/c1-7-4-8(2)10(6-11)9(3)5-7/h4-5,11H,6H2,1-3H3
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| FW: | 166.28300 |
|---|---|
| Bolling_Point: | 120 °C5 mm Hg(lit.) |
| MF: | C10H14S |
| Flash_Point: | >230 °F |
| Product_Name: | (2,4,6-trimethylphenyl)methanethiol |
| Density: | 0.986g/cm3 |
| CAS: | 21411-42-7 |
| Melting_Point: | 46-48 °C(lit.) |
| Computational_Chemistry: | ['1. XlogP :31 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 1 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :110 ', '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'] |
|---|---|
| Flash_Point: | >230 °F |
| Vapor_Pressure: | 0.0186mmHg at 25°C |
| PSA: | 38.80000 |
| Density: | 0.986g/cm3 |
| Refractive_Index: | 1.547 |
| FW: | 166.28300 |
| LogP: | 3.04160 |
| Bolling_Point: | 120 °C5 mm Hg(lit.) |
| Exact_Mass: | 166.08200 |
| MF: | C10H14S |
| Melting_Point: | 46-48 °C(lit.) |
| RIDADR: | UN2811 |
|---|---|
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
| HS_Code: | 2930909090 |
| Risk_Statements(EU): | 20/21/22-36/37/38 |
| WGK_Germany: | 3 |
| Safety_Statements: | S23-S26-S36 |
