2-[(Cyclohexyloxy)Carbonyl]Benzoic Acid

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Properties Simple | Detailed

Formula C14H16O4
IUPAC Name 2-(cyclohexoxycarbonyl)benzoic acid
Molecular Mass 248.274 g·mol−1
Heat of Formation -702.6 ± 16.7 kJ·mol−1
Dipole Moment 2.91 ± 1.08 D
Volume 294.87 Å 3
Surface Area 264.57 Å 2
HOMO Energy -10.43 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-benzenedicarboxylic acid, monocyclohexyl ester
  • 1,2-benzenedicarboxylic acid, monocyclohexyl ester (9ci)
  • 2-(cyclohexoxy-oxomethyl)benzoic acid
  • 2-cyclohexyloxycarbonylbenzoic acid
  • cyclohexyl hydrogen phthalate
  • monocyclohexyl phthalate
  • oprea1_350653
  • phthalic acid, monocyclohexyl ester
CAS Number(s)
  • 7517-36-4
InChIKey PMDKYLLIOLFQPO-UHFFFAOYSA-N
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Elements H C O