Identification | More | [Name]
3-(3-Trifluoromethylphenyl)propionic acid | [CAS]
585-50-2 | [Synonyms]
3-(3-(TRIFLUOROMETHYL)PHENYL)PROPANOIC ACID 3-(3'-TRIFLUOROMETHYLPHENYL)-PROPIONIC ACID 3-(3-TRIFLUOROMETHYLPHENYL)PROPIONIC ACID RARECHEM AL BO 1070 | [EINECS(EC#)]
639-439-3 | [Molecular Formula]
C10H9F3O2 | [MDL Number]
MFCD00090487 | [Molecular Weight]
218.17 | [MOL File]
585-50-2.mol |
Chemical Properties | Back Directory | [Melting point ]
35°C(lit.) | [Boiling point ]
149°C/11mmHg(lit.) | [density ]
1.307±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Chloroform (Slightly), Methanol (Slightly) | [form ]
Oil | [pka]
4.56±0.10(Predicted) | [color ]
Colourless | [InChI]
InChI=1S/C10H9F3O2/c11-10(12,13)8-3-1-2-7(6-8)4-5-9(14)15/h1-3,6H,4-5H2,(H,14,15) | [InChIKey]
YLTJJMIWCCJIHI-UHFFFAOYSA-N | [SMILES]
C1=CC(=CC(=C1)C(F)(F)F)CCC(=O)O | [CAS DataBase Reference]
585-50-2(CAS DataBase Reference) |
Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . | [Hazard Note ]
Irritant | [HS Code ]
2916399090 |
Hazard Information | Back Directory | [Description]
3-(3-Trifluoromethylphenyl)propionic acid is an important organic solvent with a mild, pleasant aroma, used as an efficient organic reagent in polymer production processes and as a co-catalyst for trifluoroacetic acid. It is used in biological research as a substrate for the synthesis of various compounds and for the study of enzyme-catalysed reactions. It is also used in the synthesis of cinacalcet. Cinacalcet is a drug used to treat chronic kidney disease (dialysis) and high levels of calcium in the blood (parathyroid disease). | [Chemical Properties]
White Crysstalline | [Uses]
3-(3-Trifluoromethylphenyl)propionic Acid (585-50-2) can be used as catalysts.
| [Preparation]
3-(3-Trifluoromethylphenyl)propionic acid is synthesised by the reaction of 3-trifluoromethylaniline and propionic acid. |
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