![5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID (CAS: 54022-99-0) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0640211.png "5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID chemical structure")
5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID
Catalog No: FT-0640211
CAS No: 54022-99-0
- Chemical Name: 5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID
- Molecular Formula: C12H7F3O3
- Molecular Weight: 256.18
- InChI Key: ADRFTNFHVKVATK-UHFFFAOYSA-N
- InChI: InChI=1S/C12H7F3O3/c13-12(14,15)8-3-1-2-7(6-8)9-4-5-10(18-9)11(16)17/h1-6H,(H,16,17)
| 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 |
| Symbol: | GHS07 |
|---|---|
| CAS: | 54022-99-0 |
| Flash_Point: | 175.9ºC |
| Product_Name: | 5-(3-(Trifluoromethyl)phenyl)furan-2-carboxylic acid |
| Bolling_Point: | 367.3ºC at 760 mmHg |
| FW: | 256.17700 |
| Melting_Point: | 199-205 °C(lit.) |
| MF: | C12H7F3O3 |
| Density: | N/A |
| Flash_Point: | 175.9ºC |
|---|---|
| LogP: | 3.66360 |
| Bolling_Point: | 367.3ºC at 760 mmHg |
| FW: | 256.17700 |
| PSA: | 50.44000 |
| Computational_Chemistry: | ['1 . XlogP 4 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 6 ', '4 . Rotatable Bond Count 1 ', '5 . TPSA 533 ', '6 . Heavy Atom Count 18 ', '7 . Topological Polar Surface Area -1 ', '8 . Complexity 311 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1'] |
| Melting_Point: | 199-205 °C(lit.) |
| MF: | C12H7F3O3 |
| Exact_Mass: | 256.03500 |
| Molecular_Structure: | ['1 . Molar refractive index 5505 ', '2 . Molar volume 1835 ', '3 . Parachor （902K）4539 ', '4 . Surface tension 374 ', '5 . Polarizability 2182 ', '6 . Dielectric constant 未确定'] |
| 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）199-205 ', '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）无可用 ', '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'] |
| Symbol: | GHS07 |
|---|---|
| Risk_Statements(EU): | 36/37/38 |
| HS_Code: | 2932190090 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi |
| Warning_Statement: | P261-P305 + P351 + P338 |
| Safety_Statements: | H315-H319-H335 |
