4-Bromobenzoic Acid

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Properties Simple | Detailed

Formula C7H5BrO2
IUPAC Name 4-bromobenzoic acid
Molecular Mass 201.017 g·mol−1
Heat of Formation -259.2 ± 16.7 kJ·mol−1
Dipole Moment 1.21 ± 1.08 D
Volume 174.21 Å 3
Surface Area 175.75 Å 2
HOMO Energy -10.00 ± 0.55 eV
LUMO Energy 1.88 ± eV
Point Group Symmetry Cs
Synonyms
  • benzoic acid, 4-bromo-
  • benzoic acid, p-bromo-
  • p-bromobenzenecarboxylic acid
  • p-bromobenzoic acid
  • p-carboxybromobenzene
CAS Number(s)
  • 586-76-5
InChIKey TUXYZHVUPGXXQG-UHFFFAOYSA-N
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Elements H C Br O