3-Nitrophenylboronic Acid

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Properties Simple | Detailed

Formula C6H6BNO4
IUPAC Name (3-nitrophenyl)boronic acid
Molecular Mass 166.927 g·mol−1
Heat of Formation -576.9 ± 16.7 kJ·mol−1
Dipole Moment 6.84 ± 1.08 D
Volume 182.03 Å 3
Surface Area 184.33 Å 2
HOMO Energy -10.41 ± 0.55 eV
LUMO Energy 1.81 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-nitrobenzeneboronic acid
  • benzeneboronic acid, m-nitro-
  • bm115
  • boronic acid, (3-nitrophenyl)-
  • m-nitrobenzeneboronic acid
  • m-nitrophenylboronic acid
  • npb
CAS Number(s)
  • 13331-27-6
InChIKey ZNRGSYUVFVNSAW-UHFFFAOYSA-N
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