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161622-05-5

Name 3-Fluoro-5-(trifluoromethyl)benzoic acid
CAS 161622-05-5
Molecular Formula C8H4F4O2
MDL Number MFCD00061293
Molecular Weight 208.11
MOL File 161622-05-5.mol

Chemical Properties

Melting point  104 °C
Boiling point  239.6±40.0 °C(Predicted)
density  1.489±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
solubility  soluble in Methanol
form  powder to crystal
pka 3.43±0.10(Predicted)
color  White to Light yellow to Light orange
InChI InChI=1S/C8H4F4O2/c9-6-2-4(7(13)14)1-5(3-6)8(10,11)12/h1-3H,(H,13,14)
InChIKey NSGKIIGVPBTOBF-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC(C(F)(F)F)=CC(F)=C1
CAS DataBase Reference 161622-05-5(CAS DataBase Reference)

Safety Data

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 .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  3
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  29163990

Hazard Information

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