4-CHLOROPHENYL ISOTHIOCYANATE
Catalog No: FT-0618243
CAS No: 2131-55-7
- Molecular Formula: 169.63
- Formula Weight: C7H4ClNS
- Inchl Key: MZZVFXMTZTVUFO-UHFFFAOYSA-N
- Inchl: InChI=1S/C7H4ClNS/c8-6-1-3-7(4-2-6)9-5-10/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: | GHS06, GHS08 |
|---|---|
| CAS: | 2131-55-7 |
| Flash_Point: | 105.1±19.8 °C |
| Product_Name: | 4-chlorophenyl isothiocyanate |
| Bolling_Point: | 250.2±13.0 °C at 760 mmHg |
| FW: | 169.631 |
| Melting_Point: | 42-44 °C(lit.) |
| MF: | C7H4ClNS |
| Density: | 1.2±0.1 g/cm3 |
| Refractive_Index: | 1.594 |
|---|---|
| Vapor_Pressure: | 0.0±0.5 mmHg at 25°C |
| Flash_Point: | 105.1±19.8 °C |
| LogP: | 3.91 |
| Bolling_Point: | 250.2±13.0 °C at 760 mmHg |
| PSA: | 44.45000 |
| Molecular_Structure: | ['1 . Molar refractive index 4995 ', '2 . Molar volume （m3/mol）1386 ', '3 . Parachor （902K）3471 ', '4 . Surface tension 393 ', '5 . Polarizability （10 -24cm 3）1980'] |
| 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 444 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :146 ', '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: | 42-44 °C(lit.) |
| MF: | C7H4ClNS |
| Exact_Mass: | 168.975296 |
| FW: | 169.631 |
| Density: | 1.2±0.1 g/cm3 |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density（g/mL,20 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）42-44 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC, 24mmHg）135-136 ', '7 . Refractive index（nD20）Unknow ', '8 . Flash point（ºC）110 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,100ºC）Unknow ', '12 . Saturated vapor pressure（kPa,20ºC）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'] |
| Symbol: | GHS06, GHS08 |
|---|---|
| RIDADR: | UN 2206 6.1/PG 2 |
| HS_Code: | 2930909090 |
| Packing_Group: | III |
| Hazard_Class: | 8 |
| Risk_Statements(EU): | R23/24/25;R36/37/38 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges |
| RTECS: | NX8473000 |
| Hazard_Codes: | Xn:Harmful; |
| Warning_Statement: | P261-P280-P301 + P310-P305 + P351 + P338-P311 |
| Safety_Statements: | H301 + H311 + H331-H315-H317-H319-H334-H335 |
