4-chloro-2-(trifluoromethyl)benzoic acid
Catalog No: FT-0702993
CAS No: 142994-09-0
- Chemical Name: 4-chloro-2-(trifluoromethyl)benzoic acid
- Molecular Formula: C8H4ClF3O2
- Molecular Weight: 224.56 g/mol
- InChI Key: RKZXXMAQKMOZLK-UHFFFAOYSA-N
- InChI: InChI=1S/C8H4ClF3O2/c9-4-1-2-5(7(13)14)6(3-4)8(10,11)12/h1-3H,(H,13,14)
| 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 |
|---|---|
| FW: | 224.564 |
| CAS: | 142994-09-0 |
| MF: | C8H4ClF3O2 |
| Flash_Point: | 113.9±27.3 °C |
| Product_Name: | 4-Chloro-2-(trifluoromethyl)benzoic acid |
| Bolling_Point: | 264.7±40.0 °C at 760 mmHg |
| Density: | 1.5±0.1 g/cm3 |
| FW: | 224.564 |
|---|---|
| Refractive_Index: | 1.496 |
| Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
| Flash_Point: | 113.9±27.3 °C |
| LogP: | 3.82 |
| Bolling_Point: | 264.7±40.0 °C at 760 mmHg |
| More_Info: | ['1 . Appearance 浅棕色粉末 ', '2 . Density(g/mL,20℃)1523 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)108-110 ', '5 . Boiling point(ºC,Atmospheric pressure)265 ', '6 . Boiling point(ºC,KPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)114 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(Pa,20ºC)Unknow ', '12 . Saturated vapor pressure(KPa,20ºC)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 Unknow'] |
| Computational_Chemistry: | ['1. XlogP :3 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :229 ', '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: | C8H4ClF3O2 |
| Exact_Mass: | 223.985199 |
| Molecular_Structure: | ['1. Molar refractive index 4305 ', '2. Molar volume 1474 ', '3. Parachor (902K)3624 ', '4. Surface tension 365 ', '5. Dielectric constant N/A ', '6. Polarizability 1706 ', '7. Single isotope mass 223985192 Da ', '8. Nominal mass 224 Da ', '9. Average mass 2245644 Da'] |
| Density: | 1.5±0.1 g/cm3 |
| PSA: | 37.30000 |
| RIDADR: | UN 3265 |
|---|---|
| Hazard_Codes: | Xi:Irritant; |
| HS_Code: | 2916399090 |
| Risk_Statements(EU): | R36/37/38 |
| Safety_Statements: | S26 |
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