2-Methylphenyl isothiocyanate
Catalog No: FT-0612730
CAS No: 614-69-7
- Molecular Formula: 149.21
- Formula Weight: C8H7NS
- Inchl Key: JYKYYPPZLPVIBY-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H7NS/c1-7-4-2-3-5-8(7)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: | 614-69-7 |
| MF: | C8H7NS |
| Flash_Point: | 107 °C |
| Product_Name: | 2-Methylphenyl isothiocyanate |
| Density: | 1.11 |
| FW: | 149.21300 |
| Bolling_Point: | 239 °C |
| Refractive_Index: | 1.6351-1.6371 |
|---|---|
| Flash_Point: | 107 °C |
| LogP: | 2.72930 |
| Bolling_Point: | 239 °C |
| Water_Solubility: | MAY DECOMPOSE |
| PSA: | 44.45000 |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 4705 ', '2 . Molar volume （m3/mol）1451 ', '3 . Parachor （902K）3494 ', '4 . Surface tension 336 ', '5 . Polarizability （10 -24cm 3）1865'] |
| Computational_Chemistry: | ['1. XlogP :37 ', '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 :149 ', '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: | C8H7NS |
| Exact_Mass: | 149.03000 |
| FW: | 149.21300 |
| Density: | 1.11 |
| More_Info: | ['物性数据 1 . Density 111 ', '2 . Refractive index16351-16371 ', '3 . Flash point（℃）107 ', '4 . Boiling point239'] |
| Hazard_Class: | 6.1 |
|---|---|
| Risk_Statements(EU): | R20/21/22;R42/43 |
| RIDADR: | 2206 |
| Hazard_Codes: | Xn:Harmful; |
| HS_Code: | 2930909090 |
| Safety_Statements: | S45-S36/37/39-S26-S37/39 |
| Packing_Group: | III |
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