| | Identification | More |  | [Name] 
 2,3,6-TRIFLUOROPHENYLACETIC ACID
 |  | [CAS] 
 114152-23-7
 |  | [Synonyms] 
 2,3,6-TRIFLUOROPHENYLACETIC ACID
 RARECHEM AL BO 0509
 |  | [Molecular Formula] 
 C8H5F3O2
 |  | [MDL Number] 
 MFCD00061217
 |  | [Molecular Weight] 
 190.12
 |  | [MOL File] 
 114152-23-7.mol
 | 
 | Chemical Properties | Back Directory |  | [Melting point ] 
 111-114 °C(lit.)
 
 |  | [Boiling point ] 
 249.5±35.0 °C(Predicted)
 |  | [density ] 
 1.468±0.06 g/cm3(Predicted)
 |  | [storage temp. ] 
 Sealed in dry,Room Temperature
 |  | [form ] 
 Crystalline Powder
 |  | [pka] 
 3.53±0.10(Predicted)
 |  | [color ] 
 White to slightly yellow
 |  | [InChI] 
 InChI=1S/C8H5F3O2/c9-5-1-2-6(10)8(11)4(5)3-7(12)13/h1-2H,3H2,(H,12,13)
 |  | [InChIKey] 
 QRAZASHLGLHKEB-UHFFFAOYSA-N
 |  | [SMILES] 
 C1(CC(O)=O)=C(F)C=CC(F)=C1F
 |  | [CAS DataBase Reference] 
 114152-23-7(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:Wear suitable protective clothing .
 |  | [WGK Germany ] 
 3
 
 |  | [Hazard Note ] 
 Irritant
 |  | [HazardClass ] 
 IRRITANT
 |  | [HS Code ] 
 29163900
 | 
 |  |