Zileuton
Catalog No: FT-0601582
CAS No: 111406-87-2
- Chemical Name: Zileuton
- Molecular Formula: C11H12N2O2S
- Molecular Weight: 236.29
- InChI Key: MWLSOWXNZPKENC-UHFFFAOYSA-N
- InChI: InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)
| 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 |
| Symbol: | GHS07 |
|---|---|
| CAS: | 111406-87-2 |
| Flash_Point: | 225.6±29.3 °C |
| Product_Name: | Zileuton |
| Bolling_Point: | 449.4±47.0 °C at 760 mmHg |
| FW: | 236.290 |
| Melting_Point: | 157-158°C |
| MF: | C11H12N2O2S |
| Density: | 1.4±0.1 g/cm3 |
| Refractive_Index: | 1.704 |
|---|---|
| Vapor_Pressure: | 0.0±1.2 mmHg at 25°C |
| Flash_Point: | 225.6±29.3 °C |
| LogP: | 3.74 |
| Bolling_Point: | 449.4±47.0 °C at 760 mmHg |
| FW: | 236.290 |
| PSA: | 94.80000 |
| Computational_Chemistry: | ['1. XlogP :16 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :2 ', '6. TPSA 948 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :275 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | 157-158°C |
| MF: | C11H12N2O2S |
| Exact_Mass: | 236.061951 |
| Molecular_Structure: | ['1 . Molar refractive index 6548 ', '2 . Molar volume 1686 ', '3 . Parachor （902K）4858 ', '4 . Surface tension 688 ', '5 . Polarizability 2596'] |
| Density: | 1.4±0.1 g/cm3 |
| More_Info: | ['1. Appearance :针状结晶 ', '2. Melting point（ºC）157～158℃。'] |
| Symbol: | GHS07 |
|---|---|
| HS_Code: | 2934999090 |
| WGK_Germany: | 3 |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi |
| Warning_Statement: | P305 + P351 + P338 |
| Safety_Statements: | H302-H319 |
