2-Chloro-4-(trifluoromethyl)phenylboronic acid Structure

2-Chloro-4-(trifluoromethyl)phenylboronic acid

Chemical Properties

Melting point 70-72
Boiling point 287.6±50.0 °C(Predicted)
Density  1.49±0.1 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
solubility  soluble in Methanol
form  powder to crystal
pka 7.97±0.58(Predicted)
color  White to Almost white
InChI 1S/C7H5BClF3O2/c9-4-1-2-6(8(13)14)5(3-4)7(10,11)12/h1-3,13-14H
InChIKey YAPBOBGBYQQYHX-UHFFFAOYSA-N
SMILES OB(C1=CC=C(Cl)C=C1C(F)(F)F)O
CAS DataBase Reference 313545-41-4(CAS DataBase Reference)
UNSPSC Code 12352106
NACRES NA.21

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H319
Precautionary statements P305+P351+P338
Hazard Codes  Xi
Risk Statements  36-36/37/38
Safety Statements  26-37
HazardClass  IRRITANT
HS Code  29319090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
NFPA 704:
1
2 0

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