4-FLUORO-3-METHYLPHENYL ISOTHIOCYANATE
Catalog No: FT-0644484
CAS No: 351003-66-2
- Chemical Name: 4-FLUORO-3-METHYLPHENYL ISOTHIOCYANATE
- Molecular Formula: C8H6FNS
- Molecular Weight: 167.21
- InChI Key: UNHFKKWNCOJAKR-UHFFFAOYSA-N
- InChI: InChI=1S/C8H6FNS/c1-6-4-7(10-5-11)2-3-8(6)9/h2-4H,1H3
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Product_Name: | 1-fluoro-4-isothiocyanato-2-methylbenzene |
|---|---|
| Flash_Point: | 110.4ºC |
| Melting_Point: | N/A |
| FW: | 167.20300 |
| Density: | 1.19 |
| CAS: | 351003-66-2 |
| Bolling_Point: | 215ºC(lit.) |
| MF: | C8H6FNS |
| Density: | 1.19 |
|---|---|
| Computational_Chemistry: | ['1. XlogP :38 ', '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 444 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :177 ', '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'] |
| Molecular_Structure: | ['1 . Molar refractive index 4692 ', '2 . Molar volume 1481 ', '3 . Parachor (902K)3496 ', '4 表面张力(dyne/cm)310 ', '5 . Polarizability (10-24cm3)1860'] |
| LogP: | 2.86840 |
| Flash_Point: | 110.4ºC |
| Refractive_Index: | n20/D 1.6090(lit.) |
| FW: | 167.20300 |
| PSA: | 44.45000 |
| MF: | C8H6FNS |
| Bolling_Point: | 215ºC(lit.) |
| Exact_Mass: | 167.02000 |
| Hazard_Codes: | Xi |
|---|---|
| HS_Code: | 2930909090 |
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