4-(METHYLTHIO)PHENYL ISOCYANATE
Catalog No: FT-0619089
CAS No: 1632-84-4
- Molecular Formula: 165.21
- Formula Weight: C8H7NOS
- Inchl Key: QNKQBDZVEKZFBN-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H7NOS/c1-11-8-4-2-7(3-5-8)9-6-10/h2-5H,1H3
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | N/A |
|---|---|
| CAS: | 1632-84-4 |
| MF: | C8H7NOS |
| Flash_Point: | 220 °F |
| Product_Name: | 1-isocyanato-4-methylsulfanylbenzene |
| Density: | 1.176 g/mL at 25 °C(lit.) |
| FW: | 165.21200 |
| Bolling_Point: | 117-118 °C8 mm Hg(lit.) |
| Refractive_Index: | n20/D 1.606(lit.) |
|---|---|
| Vapor_Pressure: | 0.0207mmHg at 25°C |
| Flash_Point: | 220 °F |
| LogP: | 2.37580 |
| Bolling_Point: | 117-118 °C8 mm Hg(lit.) |
| FW: | 165.21200 |
| PSA: | 54.73000 |
| Computational_Chemistry: | ['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 547 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :158 ', '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'] |
| MF: | C8H7NOS |
| Exact_Mass: | 165.02500 |
| Molecular_Structure: | ['1 . Molar refractive index 4839 ', '2 . Molar volume （m3/mol）1483 ', '3 . Parachor （902K）3758 ', '4 . Surface tension 412 ', '5 . Dielectric constant （F/m）不可用 ', '6 . Polarizability （10 -24cm 3）1918'] |
| Density: | 1.176 g/mL at 25 °C(lit.) |
| More_Info: | ['1 . Appearance 带刺激性气味的Colourless Liquid 。 ', '2 . Density（g/mL,25/4℃） 1176 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）117-118 ', '6 . Boiling point（ºC,52kPa） Unknow ', '7 . Refractive index 1606 ', '8 . Flash point（ºC） 104 ', '9 . Specific rotation（º） 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 可Water 解'] |
| Hazard_Class: | 6.1 |
|---|---|
| Risk_Statements(EU): | R20/21/22 |
| WGK_Germany: | 3 |
| RIDADR: | UN 2206 6.1/PG 3 |
| Hazard_Codes: | Xn |
| HS_Code: | 2930909090 |
| Safety_Statements: | S23-S26-S36/37/39-S45 |
| Packing_Group: | III |
Related Products
3,4-Pyrrolidinediol, 2-[(4-methoxyphenyl)methyl]-, 3-acetate, (2S,3R,4R)-
(4S)-2-[[[(2R)-2-AMino-2-(4-hydroxyphenyl)acetyl]aMino]Methyl]-5,5-diMethyl-4-thiazolidinecarboxylic Acid (Mixture of DiastereoMers)