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3-Bromo-5-carboxybenzeneboronic acid 97 Structure

3-Bromo-5-carboxybenzeneboronic acid 97

  • Product Name3-Bromo-5-carboxybenzeneboronic acid 97
  • CAS913835-73-1
  • CBNumberCB9500422
  • MFC7H6BBrO4
  • MW244.84
  • MDL NumberMFCD08689487
  • MOL File913835-73-1.mol

Chemical Properties

Melting point: 290-292
Boiling point: 480.7±55.0 °C(Predicted)
Density  1.86±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
form  solid
pka 3.82±0.10(Predicted)
Appearance White to off-white Solid
InChI 1S/C7H6BBrO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,12-13H,(H,10,11)
InChIKey CWBLIPMCDMSOFX-UHFFFAOYSA-N
SMILES OB(O)c1cc(Br)cc(c1)C(O)=O

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi
WGK Germany  3
Hazard Note  Irritant/Keep Cold
HS Code  2931900090
Storage Class 13 - Non Combustible Solids
NFPA 704:
0
2 0

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3-Bromo-5-carboxybenzeneboronic acid 97 Spectrum