6-CHLOROTHIOCHROMAN-4-ONE
Catalog No: FT-0621095
CAS No: 13735-12-1
- Chemical Name: 6-CHLOROTHIOCHROMAN-4-ONE
- Molecular Formula: C9H7ClOS
- Molecular Weight: 198.67
- InChI Key: OKHUUKHZUNKSQA-UHFFFAOYSA-N
- InChI: InChI=1S/C9H7ClOS/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2
| 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 |
| Symbol: | GHS07 |
|---|---|
| CAS: | 13735-12-1 |
| Flash_Point: | 161.1ºC |
| Product_Name: | 6-chloro-2,3-dihydrothiochromen-4-one |
| Bolling_Point: | 342.7ºC at 760mmHg |
| FW: | 198.66900 |
| Melting_Point: | 67-71 °C(lit.) |
| MF: | C9H7ClOS |
| Density: | 1.377g/cm3 |
| Refractive_Index: | 1.634 |
|---|---|
| Vapor_Pressure: | 7.39E-05mmHg at 25°C |
| Flash_Point: | 161.1ºC |
| LogP: | 3.01850 |
| Bolling_Point: | 342.7ºC at 760mmHg |
| PSA: | 42.37000 |
| Molecular_Structure: | ['1 . Molar refractive index 5161 ', '2 . Molar volume （m3/mol）1441 ', '3 . Parachor （902K）3872 ', '4 . Surface tension 520 ', '5 . Polarizability 2046'] |
| Computational_Chemistry: | ['1. XlogP :25 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 424 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :195 ', '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: | 67-71 °C(lit.) |
| MF: | C9H7ClOS |
| Exact_Mass: | 197.99100 |
| FW: | 198.66900 |
| Density: | 1.377g/cm3 |
| Symbol: | GHS07 |
|---|---|
| Risk_Statements(EU): | R36/37/38 |
| HS_Code: | 2932999099 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Faceshields;Gloves |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi:Irritant; |
| Warning_Statement: | P280 |
| Safety_Statements: | H317 |
