3-PYRIDYL ISOTHIOCYANATE
Catalog No: FT-0616374
CAS No: 17452-27-6
- Molecular Formula: 136.18
- Formula Weight: C6H4N2S
- Inchl Key: VMSZFBSYWXMXRF-UHFFFAOYSA-N
- Inchl: InChI=1S/C6H4N2S/c9-5-8-6-2-1-3-7-4-6/h1-4H
| 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: | GHS05 |
|---|---|
| CAS: | 17452-27-6 |
| Flash_Point: | 229 °F |
| Product_Name: | 3-Isothiocyanatopyridine |
| Bolling_Point: | 231-233ºC(lit.) |
| FW: | 136.17400 |
| Melting_Point: | N/A |
| MF: | C6H4N2S |
| Density: | 1.22 g/mL at 25ºC(lit.) |
| Refractive_Index: | n20/D 1.665(lit.) |
|---|---|
| Vapor_Pressure: | 0.0286mmHg at 25°C |
| Flash_Point: | 229 °F |
| LogP: | 1.81590 |
| Bolling_Point: | 231-233ºC(lit.) |
| FW: | 136.17400 |
| PSA: | 57.34000 |
| Computational_Chemistry: | ['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 573 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :129 ', '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: | C6H4N2S |
| Exact_Mass: | 136.01000 |
| Molecular_Structure: | ['1 . Molar refractive index 4107 ', '2 . Molar volume （m3/mol）1184 ', '3 . Parachor （902K）2995 ', '4 . Surface tension 408 ', '5 . Polarizability 1628'] |
| Density: | 1.22 g/mL at 25ºC(lit.) |
| More_Info: | ['1 . Appearance 不确定 ', '2 . Density（g/mL,25/4℃）122(lit) ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）不确定 ', '5 . Boiling point（ºC,Atmospheric pressure）231-233(lit) ', '6 . Boiling point（ºC, 52kPa）不确定 ', '7 . Refractive indexn20/D1665(lit) ', '8 . Flash point（ºF）229 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定'] |
| Symbol: | GHS05 |
|---|---|
| Risk_Statements(EU): | 34 |
| HS_Code: | 2933399090 |
| Personal_Protective_Equipment: | Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| RIDADR: | UN 3334 |
| Hazard_Codes: | C: Corrosive;Xi: Irritant; |
| Warning_Statement: | P280-P305 + P351 + P338-P310 |
| Safety_Statements: | H314 |
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