ETHYL 1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE
Catalog No: FT-0642728
CAS No: 111493-74-4
- Chemical Name: ETHYL 1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE
- Molecular Formula: C8H9F3N2O2
- Molecular Weight: 222.16
- InChI Key: ZZEXDJGNURSJOF-UHFFFAOYSA-N
- InChI: InChI=1S/C8H9F3N2O2/c1-3-15-7(14)5-4-13(2)12-6(5)8(9,10)11/h4H,3H2,1-2H3
| 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 |
| Melting_Point: | 60-61ºC |
|---|---|
| CAS: | 111493-74-4 |
| MF: | C8H9F3N2O2 |
| Flash_Point: | 115.5ºC |
| Product_Name: | Ethyl 1-Methyl-3-(Trifluoromethyl)-1H-Pyrazole-4-Carboxylate |
| Density: | 1.35g/cm3 |
| FW: | 222.16400 |
| Bolling_Point: | 267.4ºC at 760mmHg |
| Refractive_Index: | 1.469 |
|---|---|
| Vapor_Pressure: | 0.00816mmHg at 25°C |
| Flash_Point: | 115.5ºC |
| LogP: | 1.61560 |
| Bolling_Point: | 267.4ºC at 760mmHg |
| FW: | 222.16400 |
| PSA: | 44.12000 |
| Computational_Chemistry: | ['1. XlogP :14 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 441 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :245 ', '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: | 60-61ºC |
| MF: | C8H9F3N2O2 |
| Exact_Mass: | 222.06200 |
| Molecular_Structure: | ['1 . Molar refractive index 4588 ', '2 . Molar volume 1645 ', '3 . Parachor (902K)3875 ', '4 . Surface tension 307 ', '5 . Polarizability 1819'] |
| Density: | 1.35g/cm3 |
| More_Info: | ['1. Melting point(ºC)60~61'] |
| Hazard_Codes: | Xi: Irritant; |
|---|---|
| HS_Code: | 2933199090 |
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