5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID Structure

5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID

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)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
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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5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID Spectrum