CAS Number455-24-3
Synonyms4-(Trifluoromethyl)benzoic acid; P-CARBOXYBENZOTRIFLUORIDE; a,a,a-trifluoro-p-toluic acid; 4-TRIFLUOROMETHYLBENZOIC ACID; α,α,α-trifluoro-p-toluic acid; p-Trifluoromethylbenzoic acid; PTF-BOA; QVR DXFFF; 4-Carboxybenzotrifluoride; para-trifluoromethylbenzoic acid; p-(Trifluoromethyl)benzoic acid; p-CF3-benzoic acid; EINECS 207-242-8; MFCD00002562
Molecular FormulaCF3C6H4CO2H
Molecular Weight190.12
Purity98%
Density1.4±0.1 g/cm3
Boiling Point243.2±40.0 °C at 760 mmHg
Melting Point219-220 °C (lit.)
Appearancepowder
EINECS207-242-8
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 455-24-3 |
| Catalog No. | 2A-9006138 |
| Chinese Name | 4-三氟甲基苯甲酸 |
| Synonyms | 4-(Trifluoromethyl)benzoic acid; P-CARBOXYBENZOTRIFLUORIDE; a,a,a-trifluoro-p-toluic acid; 4-TRIFLUOROMETHYLBENZOIC ACID; α,α,α-trifluoro-p-toluic acid; p-Trifluoromethylbenzoic acid; PTF-BOA; QVR DXFFF; 4-Carboxybenzotrifluoride; para-trifluoromethylbenzoic acid; p-(Trifluoromethyl)benzoic acid; p-CF3-benzoic acid; EINECS 207-242-8; MFCD00002562 |
| Molecular Formula | CF3C6H4CO2H |
| Molecular Weight | 190.12 |
| Purity | 98 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 243.2±40.0 °C at 760 mmHg |
| Melting Point | 219-220 °C (lit.) |
| Appearance | powder |
| Storage Condition | Store in a sealed container in a ventilated and dr |
| Application | 4-(Trifluoromethyl)benzoic acid is a biochemical reagent that can be used as a biological material or organic compound in life science-related research. |
| EINECS | 207-242-8 |
| HTC | 29163900 |
| PubChem ID | 24851805 |
| MDL Number | MFCD00002562 |
| SMILES | OC(=O)c1ccc(cc1)C(F)(F)F |
| InChI | 1S/C8H5F3O2/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13) |
| InChI Key | SWKPKONEIZGROQ-UHFFFAOYSA-N |
| Beilstein/REAXYS | 2049241 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | Transport |
| Risk Codes | R36/37/38 |
| Safety Description | S24/25 |
| MSDS | msds/6138_1_455_24_3.pdf |
| Bioactivity | 4-(Trifluoromethyl)benzoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research. Related Catalog Research Areas >> Others In Vitro 4-(Trifluoromethyl)benzoic acid is used in the synthesis of salicylanilide 4-(trifluoromethyl)benzoate via N,N'-dicyclohexylcarbodiimide coupling in anhydrous N,N-dimethylformamide. Used as an internal standard in GC/MS methods for ultra-trace level analysis of fluorinated aromatic carboxylic acids. Chemical & Physical Properties Density 1.4±0.1 g/cm3 Boiling Point 243.2±40.0 °C at 760 mmHg Melting Point 219-220 °C(lit.) Molecular Formula C8H5F3O2 Molecular Weight 190.12 Flash Point 100.9±27.3 °C Exact Mass 190.024170 PSA 37.30000 LogP 3.10 Vapor Pressure 0.0±0.5 mmHg at 25°C Index of Refraction 1.475 InChIKey SWKPKONEIZGROQ-UHFFFAOYSA-N SMILES O=C(O)c1ccc(C(F)(F)F)cc1 |
| Use of | Properties Name 4-(Trifluoromethyl)benzoic acid Synonym More Synonyms 4-(Trifluoromethyl)benzoic acid Biological Activity Description 4-(Trifluoromethyl)benzoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research. >> Others In Vitro 4-(Trifluoromethyl)benzoic acid was used in the synthesis of salicylanilide 4-(trifluoromethyl)benzoate in anhydrous N,N-dimethylformamide via N,N'-dicyclohexylcarbodiimide coupling. Used as an internal standard in GC/MS methods for ultra-trace level analysis of fluorinated aromatic carboxylic acids. Chemical & Physical Properties Molecular Formula C8H5F3O2 Exact Mass 190.024170 PSA 37.30000 Index of Refraction 1.475 InChIKey SWKPKONEIZGROQ-UHFFFAOYSA-N |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip. |
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