2-[(Phenylthio)methyl]-2-cyclopenten-1-one
Catalog No: FT-0601886
CAS No: 76047-52-4
- Molecular Formula: 204.28800
- Formula Weight: C12H12OS
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Product_Name: | 2-(phenylsulfanylmethyl)cyclopent-2-en-1-one |
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Flash_Point: | >230 °F |
Melting_Point: | N/A |
FW: | 204.28800 |
Density: | 1.17 g/mL at 25ºC(lit.) |
CAS: | 76047-52-4 |
Bolling_Point: | 145-150ºC0.8 mm Hg(lit.) |
MF: | C12H12OS |
Density: | 1.17 g/mL at 25ºC(lit.) |
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Computational_Chemistry: | ['1. XlogP :26 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :7 ', '6. TPSA 424 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :239 ', '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'] |
LogP: | 3.06800 |
Flash_Point: | >230 °F |
Refractive_Index: | n20/D 1.6088(lit.) |
FW: | 204.28800 |
PSA: | 42.37000 |
MF: | C12H12OS |
Bolling_Point: | 145-150ºC0.8 mm Hg(lit.) |
Exact_Mass: | 204.06100 |
Personal_Protective_Equipment: | Eyeshields;Gloves |
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RIDADR: | UN 3334 |