2-Thiopheneacetonitrile
Catalog No: FT-0638060
CAS No: 20893-30-5
- Molecular Formula: 123.18
- Formula Weight: C6H5NS
- Inchl Key: CLSHQIDDCJTHAJ-UHFFFAOYSA-N
- Inchl: InChI=1S/C6H5NS/c7-4-3-6-2-1-5-8-6/h1-2,5H,3H2
| 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: | Warning |
|---|---|
| Flash_Point: | 101.7±0.0 °C |
| Density: | 1.2±0.1 g/cm3 |
| FW: | 123.176 |
| Bolling_Point: | 224.3±15.0 °C at 760 mmHg |
| MF: | C6H5NS |
| Product_Name: | 2-Thiopheneacetonitrile |
| CAS: | 20893-30-5 |
| Melting_Point: | -5ºC |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 52 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :113 ', '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: | 101.7±0.0 °C |
| More_Info: | ['1. Appearance Colourless or 淡Yellow Liquid 。 ', '2. Density（g/mL,25/4℃）1157 ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）Unknow ', '5. Boiling point（ºC,Atmospheric pressure）115-120 ', '6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive indexUnknow ', '8. Flash point（ºC）101 ', '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 Unknow'] |
| PSA: | 52.03000 |
| Vapor_Pressure: | 0.1±0.4 mmHg at 25°C |
| Density: | 1.2±0.1 g/cm3 |
| Refractive_Index: | 1.562 |
| FW: | 123.176 |
| LogP: | 1.13 |
| Bolling_Point: | 224.3±15.0 °C at 760 mmHg |
| Exact_Mass: | 123.014267 |
| MF: | C6H5NS |
| Melting_Point: | -5ºC |
| Molecular_Structure: | ['1 . Molar refractive index 3409 ', '2 . Molar volume (m3/mol)1051 ', '3 . Parachor (902K)2753 ', '4 表面张力(dyne/cm)470 ', '5 . Polarizability (10-24cm3)1351'] |
| Warning_Statement: | P261-P280-P305 + P351 + P338 |
|---|---|
| Symbol: | Warning |
| RIDADR: | UN 3276 6.1/PG 3 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| WGK_Germany: | 3 |
| Safety_Statements: | H302 + H312 + H332-H315-H319-H335 |
| Risk_Statements(EU): | R20/21/22;R36/37/38 |
| HS_Code: | 29349990 |
| Hazard_Class: | 6.1 |
| Hazard_Codes: | Xn:Harmful; |
| Packing_Group: | III |
