2,3,6-Trimethylbenzoic Acid

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Properties Simple | Detailed

Formula C10H12O2
IUPAC Name 2,3,6-trimethylbenzoic acid
Molecular Mass 164.201 g·mol−1
Heat of Formation -387.6 ± 16.7 kJ·mol−1
Dipole Moment 1.76 ± 1.08 D
Volume 208.35 Å 3
Surface Area 199.2 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.22 ± eV
Point Group Symmetry C1
Synonyms
  • benzoic acid, 2,3,6-trimethyl-
CAS Number(s)
  • 2529-36-4
InChIKey JRUKSSBDIZXQDX-UHFFFAOYSA-N
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Elements H C O