METHYL 3-(TRIFLUOROMETHOXY)BENZOATE
Catalog No: FT-0628494
CAS No: 148438-00-0
- Chemical Name: METHYL 3-(TRIFLUOROMETHOXY)BENZOATE
- Molecular Formula: C9H7F3O3
- Molecular Weight: 220.14
- InChI Key: YWSQRIKZJLRGPT-UHFFFAOYSA-N
- InChI: InChI=1S/C9H7F3O3/c1-14-8(13)6-3-2-4-7(5-6)15-9(10,11)12/h2-5H,1H3
| 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: | N/A |
|---|---|
| CAS: | 148438-00-0 |
| MF: | C9H7F3O3 |
| Flash_Point: | 75.3±20.8 °C |
| Product_Name: | Methyl 3-(trifluoromethoxy)benzoate |
| Density: | 1.3±0.1 g/cm3 |
| FW: | 220.145 |
| Bolling_Point: | 204.0±35.0 °C at 760 mmHg |
| Refractive_Index: | 1.451 |
|---|---|
| Vapor_Pressure: | 0.3±0.4 mmHg at 25°C |
| Flash_Point: | 75.3±20.8 °C |
| LogP: | 3.12 |
| Bolling_Point: | 204.0±35.0 °C at 760 mmHg |
| FW: | 220.145 |
| PSA: | 35.53000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '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 355 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :227 ', '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'] |
| MF: | C9H7F3O3 |
| Exact_Mass: | 220.034729 |
| Molecular_Structure: | ['1. Molar refractive index 4516 ', '2. Molar volume 1677 ', '3. Parachor (902K)3924 ', '4. Surface tension 299 ', '5. Dielectric constant N/A ', '6. Polarizability 179 ', '7. Single isotope mass 220034729 Da ', '8. Nominal mass 220 Da ', '9. Average mass 2201453 Da'] |
| Density: | 1.3±0.1 g/cm3 |
| More_Info: | ['1 . Appearance Colourless 的Liquid ', '2 . Density(g/mL, 20 ℃ )1445 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC 10mmHg)85-87 ', '7 . Refractive index1443-1445 ', '8 . Flash point(ºC)85-87 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)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(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 '] |
| Safety_Statements: | S26-S36 |
|---|---|
| Hazard_Codes: | Xn,Xi |
| HS_Code: | 2918990090 |
| Risk_Statements(EU): | R36/38 |
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