Thioanisole
Catalog No: FT-0631526
CAS No: 100-68-5
- Molecular Formula: 124.21
- Formula Weight: C7H8S
- Inchl Key: HNKJADCVZUBCPG-UHFFFAOYSA-N
- Inchl: InChI=1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,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 |
| Symbol: | GHS07 |
|---|---|
| CAS: | 100-68-5 |
| Flash_Point: | 57.2±0.0 °C |
| Product_Name: | Thioanisole |
| Bolling_Point: | 193.0±0.0 °C at 760 mmHg |
| FW: | 124.203 |
| Melting_Point: | −15 °C(lit.) |
| MF: | C7H8S |
| Density: | 1.0±0.1 g/cm3 |
| Refractive_Index: | 1.569 |
|---|---|
| Vapor_Pressure: | 0.7±0.3 mmHg at 25°C |
| Flash_Point: | 57.2±0.0 °C |
| LogP: | 2.70 |
| Bolling_Point: | 193.0±0.0 °C at 760 mmHg |
| Water_Solubility: | INSOLUBLE |
| PSA: | 25.30000 |
| Molecular_Structure: | ['1 . Molar refractive index 3939 ', '2 . Molar volume 1201 ', '3 . Parachor （902K）2960 ', '4 . Surface tension 368 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', '7 . Polarizability 1561'] |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 253 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :554 ', '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: | −15 °C(lit.) |
| MF: | C7H8S |
| Exact_Mass: | 124.034668 |
| FW: | 124.203 |
| Density: | 1.0±0.1 g/cm3 |
| More_Info: | ['1 . Appearance Colourless Liquid ', '2 . Density（g/mL,20℃）10533 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）-15 ', '5 . Boiling point（ºC,Atmospheric pressure）187-188 ', '6 . Boiling point（ºC, KPa）Unknow ', '7 . Refractive index15842 ', '8 . Flash point（ºC）75 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）: Unknow ', '11 . Vapor pressure（mmHg, ºC）Unknow ', '12 . Saturated vapor pressure（kPa, ºC）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 Insoluble in Water ，可Soluble in 一般有机溶剂。'] |
| Symbol: | GHS07 |
|---|---|
| RIDADR: | UN 1993 3/PG 3 |
| HS_Code: | 29309070 |
| Packing_Group: | III |
| Hazard_Class: | 9 |
| Risk_Statements(EU): | R22;R36/37/38 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| RTECS: | DA6200000 |
| Hazard_Codes: | Xn:Harmful; |
| Warning_Statement: | P261-P305 + P351 + P338 |
| Safety_Statements: | H302-H315-H319-H335 |
