(-)-Corey Lactone 5-(4-Phenylbenzoate)
Catalog No: FT-0665168
CAS No: 31752-99-5
- Molecular Formula: 352.4
- Formula Weight: C21H20O5
- Inchl Key: SZJVIFMPKWMGSX-AKHDSKFASA-N
- Inchl: InChI=1S/C21H20O5/c22-12-17-16-10-20(23)25-18(16)11-19(17)26-21(24)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,16-19,22H,10-12H2/t16-,17-,18+,19-/m1/s1
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Flash_Point: | 210.6±22.2 °C |
|---|---|
| FW: | 352.380 |
| Bolling_Point: | 584.8±45.0 °C at 760 mmHg |
| Product_Name: | [(3aR,4S,5R,6aS)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate |
| CAS: | 31752-99-5 |
| MF: | C21H20O5 |
| Melting_Point: | 131-132 °C(lit.) |
| Density: | 1.3±0.1 g/cm3 |
| Water_Solubility: | insoluble |
|---|---|
| Bolling_Point: | 584.8±45.0 °C at 760 mmHg |
| Molecular_Structure: | ['1 . Molar refractive index 9420 ', '2 . Molar volume （m3/mol）2652 ', '3 . Parachor （902K）7372 ', '4 . Surface tension 597 ', '5 . Polarizability （10 -24cm 3）3734'] |
| LogP: | 2.33 |
| More_Info: | ['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）131-132 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）-89(c=1, CHCl3) ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用'] |
| MF: | C21H20O5 |
| Computational_Chemistry: | ['1. XlogP :31 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :2 ', '6. TPSA 728 ', '7. Heavy Atom Count :26 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :519 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :4 ', '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: | 131-132 °C(lit.) |
| Refractive_Index: | 1.629 |
| PSA: | 72.83000 |
| Flash_Point: | 210.6±22.2 °C |
| FW: | 352.380 |
| Exact_Mass: | 352.131073 |
| Vapor_Pressure: | 0.0±1.7 mmHg at 25°C |
| Density: | 1.3±0.1 g/cm3 |
| WGK_Germany: | 3 |
|---|---|
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
| Safety_Statements: | S22-S24/25 |
| RIDADR: | NONH for all modes of transport |
