54022-99-0

Name 5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID
CAS 54022-99-0
Molecular Formula C12H7F3O3
MDL Number MFCD00274244
Molecular Weight 256.18
MOL File 54022-99-0.mol

Chemical Properties

Melting point  199-205 °C(lit.)
Boiling point  367.3±42.0 °C(Predicted)
density  1.395±0.06 g/cm3(Predicted)
pka 3.00±0.10(Predicted)
InChI 1S/C12H7F3O3/c13-12(14,15)8-3-1-2-7(6-8)9-4-5-10(18-9)11(16)17/h1-6H,(H,16,17)
InChIKey ADRFTNFHVKVATK-UHFFFAOYSA-N
SMILES OC(=O)c1ccc(o1)-c2cccc(c2)C(F)(F)F
CAS DataBase Reference 54022-99-0(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 .
WGK Germany  3
Hazard Note  Irritant
HS Code  2932190090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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