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4-(Trifluoromethoxy)benzoic acid Structure

4-(Trifluoromethoxy)benzoic acid

  • Product Name4-(Trifluoromethoxy)benzoic acid
  • CAS330-12-1
  • CBNumberCB6403100
  • MFC8H5F3O3
  • MW206.12
  • EINECS206-352-3
  • MDL NumberMFCD00002541
  • MOL File330-12-1.mol

Chemical Properties

Melting point: 150-154 °C(lit.)
Boiling point: 203°C (rough estimate)
Density  1.4251 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform, Methanol
pka 3.85±0.10(Predicted)
form  Powder
color  White to cream
BRN  977356
InChI InChI=1S/C8H5F3O3/c9-8(10,11)14-6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13)
InChIKey RATSANVPHHXDCT-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC=C(OC(F)(F)F)C=C1
CAS DataBase Reference 330-12-1(CAS DataBase Reference)
NIST Chemistry Reference 4-(Trifluoromethoxy)benzoic acid(330-12-1)

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  26-36-37/39
WGK Germany  3
HazardClass  IRRITANT
HS Code  2918990090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
0
2 0

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4-(Trifluoromethoxy)benzoic acid Chemical Properties,Usage,Production

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