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2,3,6-Trifluorophenylacetic acid Structure

2,3,6-Trifluorophenylacetic acid

  • Product Name2,3,6-Trifluorophenylacetic acid
  • CAS114152-23-7
  • CBNumberCB3148770
  • MFC8H5F3O2
  • MW190.12
  • MDL NumberMFCD00061217
  • MOL File114152-23-7.mol

Chemical Properties

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

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs Respiratory system
PPE dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
HazardClass  IRRITANT
HS Code  2916399090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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