Introduction:Basic information about CAS 161622-05-5|3-Fluoro-5-trifluoromethylbenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-Fluoro-5-trifluoromethylbenzoic acid |
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| CAS Number | 161622-05-5 | Molecular Weight | 208.110 |
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| Density | 1.5±0.1 g/cm3 | Boiling Point | 239.6±40.0 °C at 760 mmHg |
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| Molecular Formula | C8H4F4O2 | Melting Point | 104 °C |
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| MSDS | ChineseUSA | Flash Point | 98.7±27.3 °C |
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| Symbol | GHS07 | Signal Word | Warning |
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Names
| Name | 3-Fluoro-5-(trifluoromethyl)benzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.5±0.1 g/cm3 |
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| Boiling Point | 239.6±40.0 °C at 760 mmHg |
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| Melting Point | 104 °C |
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| Molecular Formula | C8H4F4O2 |
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| Molecular Weight | 208.110 |
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| Flash Point | 98.7±27.3 °C |
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| Exact Mass | 208.014740 |
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| PSA | 37.30000 |
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| LogP | 3.06 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.459 |
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| InChIKey | NSGKIIGVPBTOBF-UHFFFAOYSA-N |
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| SMILES | O=C(O)c1cc(F)cc(C(F)(F)F)c1 |
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Safety Information
| Symbol | GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H315-H319-H335 |
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| Precautionary Statements | P261-P305 + P351 + P338 |
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| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
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| Hazard Codes | Xi |
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| Risk Phrases | R36/37/38:Irritating to eyes, respiratory system and skin . |
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| Safety Phrases | S26-S36 |
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| RIDADR | NONH for all modes of transport |
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| HS Code | 2916399090 |
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Customs
| HS Code | 2916399090 |
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| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Articles1
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| Novel small molecule bradykinin B1 receptor antagonists. Part 1: benzamides and semicarbazides. Bioorg. Med. Chem. Lett. 20(3) , 1225-8, (2010) The synthesis and SAR of two series of bradykinin B(1) receptor antagonists is described. The benzamide moiety proved to be a suitable replacement for the aryl ester functionality of biaryl based anta... | |
Synonyms
| MFCD00061293 |
| α,α,α,5-Tetrafluoro-m-toluic acid |
| QVR CF EXFFF |
| 3-fluoro-5-trifluoromethylbenzoic acid |
| 3-Fluoro-5-(trifluoromethyl)benzoic acid |
| Benzoic acid, 3-fluoro-5-(trifluoromethyl)- |