1-Chloro-2-fluoro-3-isocyanatobenzene
Catalog No: FT-0679346
CAS No: 69922-25-4
- Chemical Name: 1-Chloro-2-fluoro-3-isocyanatobenzene
- Molecular Formula: C7H3ClFNO
- Molecular Weight: 171.55
- InChI Key: SPMPFFGBFMAFOO-UHFFFAOYSA-N
- InChI: InChI=1S/C7H3ClFNO/c8-5-2-1-3-6(7(5)9)10-4-11/h1-3H
| 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-Chloro-2-fluoro-3-isocyanatobenzene |
|---|---|
| Flash_Point: | 198 °F |
| Melting_Point: | N/A |
| FW: | 171.55600 |
| Density: | 1.369 g/mL at 25ºC(lit.) |
| CAS: | 69922-25-4 |
| Bolling_Point: | 185-186ºC(lit.) |
| MF: | C7H3ClFNO |
| Density: | 1.369 g/mL at 25ºC(lit.) |
|---|---|
| Computational_Chemistry: | ['1. XlogP :35 ', '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 294 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :181 ', '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 4063 ', '2 . Molar volume 1308 ', '3 . Parachor （902K）3242 ', '4 . Surface tension 377 ', '5 . Polarizability 1610 ', '6 . Dielectric constant 未确定'] |
| LogP: | 2.44640 |
| Flash_Point: | 198 °F |
| Refractive_Index: | n20/D 1.5380(lit.) |
| FW: | 171.55600 |
| PSA: | 29.43000 |
| MF: | C7H3ClFNO |
| Bolling_Point: | 185-186ºC(lit.) |
| Exact_Mass: | 170.98900 |
| Hazard_Codes: | Xi |
|---|---|
| Risk_Statements(EU): | 36/37/38 |
| HS_Code: | 2929109000 |
| Safety_Statements: | 26-36 |
