3-Chloro-4-Hydroxybenzoic Acid

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Properties Simple | Detailed

Formula C7H5ClO3
IUPAC Name 3-chloro-4-hydroxy-benzoic acid
Molecular Mass 172.566 g·mol−1
Heat of Formation -494.2 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 177.36 Å 3
Surface Area 178.71 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-chloro-4-hydroxybenzoate
  • 3-chloro-4-hydroxybenzoic acid hemihydrate
  • 3-chloro-4-hydroxybenzoic scid
  • benzoic acid, 3-chloro-4-hydroxy-
  • benzoic acid, 3-chloro-4-hydroxy- (8ci)(9ci)
  • chb
  • fr-2027
CAS Number(s)
  • 3964-58-7
InChIKey QGNLHMKIGMZKJX-UHFFFAOYSA-N
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Elements H C O Cl