4-Bromo-2-fluorobenzeneboronic acid Structure

4-Bromo-2-fluorobenzeneboronic acid

Chemical Properties

Melting point 238-242°C
Boiling point 310.6±52.0 °C(Predicted)
Density  1.75±0.1 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
pka 8.12±0.58(Predicted)
form  solid
Appearance White to off-white Solid
Water Solubility  Insoluble in water.
InChI InChI=1S/C6H5BBrFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,10-11H
InChIKey PKZHIIVZRPUZSU-UHFFFAOYSA-N
SMILES B(C1=CC=C(Br)C=C1F)(O)O
CAS DataBase Reference 216393-64-5(CAS DataBase Reference)
UNSPSC Code 12352106
NACRES NA.21

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H319
Precautionary statements P305+P351+P338
Hazard Codes  Xi,Xn
Risk Statements  36/37/38-36-22
Safety Statements  26-36
WGK Germany  3
Hazard Note  Irritant
HS Code  2931900090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
NFPA 704:
0
2 0

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4-Bromo-2-fluorobenzeneboronic acid Spectrum