Zileuton
Catalog No: FT-0601582
CAS No: 111406-87-2
- Molecular Formula: 236.29
- Formula Weight: C11H12N2O2S
- Inchl Key: MWLSOWXNZPKENC-UHFFFAOYSA-N
- Inchl: 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 | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Symbol: | GHS07 |
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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 |
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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 |