METHYL 4,4,4-TRIFLUOROCROTONATE
Catalog No: FT-0628597
CAS No: 85694-31-1
- Chemical Name: METHYL 4,4,4-TRIFLUOROCROTONATE
- Molecular Formula: C5H5F3O2
- Molecular Weight: 154.09 g/mol
- InChI Key: DMMZYYLXAGRBDO-NSCUHMNNSA-N
- InChI: InChI=1S/C5H5F3O2/c1-10-4(9)2-3-5(6,7)8/h2-3H,1H3/b3-2+
| 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: | Methyl 4,4,4-Trifluorocrotonate |
|---|---|
| Flash_Point: | 94-95°C |
| Melting_Point: | N/A |
| FW: | 154.08700 |
| Density: | N/A |
| CAS: | 85694-31-1 |
| Bolling_Point: | 95°C |
| MF: | C5H5F3O2 |
| LogP: | 1.27790 |
|---|---|
| Flash_Point: | 94-95°C |
| Refractive_Index: | 1.3635 |
| FW: | 154.08700 |
| Bolling_Point: | 95°C |
| Computational_Chemistry: | ['1 . XlogP 15 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 5 ', '4 . Rotatable Bond Count 2 ', '5 . Isotope Atom Count ', '6 . TPSA 263 ', '7 . Heavy Atom Count 10 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 148 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 1 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1'] |
| PSA: | 26.30000 |
| MF: | C5H5F3O2 |
| More_Info: | ['1 . Appearance Colourless Liquid ', '2 . Density（g/mL25 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC, Atmospheric pressure）94-95 ', '6 . Boiling point（ºC035mmHg）Unknow ', '7 . Refractive index13635 ', '8 . Flash point（ºC）94-95 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（正Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 不能拌and or 难以拌and '] |
| Exact_Mass: | 154.02400 |
| Hazard_Codes: | Xi |
|---|---|
| Risk_Statements(EU): | R11;R36/37/38 |
| Packing_Group: | III |
| Hazard_Class: | 3 |
| RIDADR: | 3272 |
| HS_Code: | 2916190090 |
| Safety_Statements: | S16-S26-S36 |
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