Methylphthalic Acid

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Properties Simple | Detailed

Formula C9H8O4
IUPAC Name 3-methylphthalic acid
Molecular Mass 180.157 g·mol−1
Heat of Formation -669.7 ± 16.7 kJ·mol−1
Dipole Moment 3.32 ± 1.08 D
Volume 200.71 Å 3
Surface Area 193.59 Å 2
HOMO Energy -10.16 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-benzenedicarboxylic acid, 3-methyl-
  • 3-methyl-1,2-benzenedicarboxylic acid
  • 3-methylphthalate
CAS Number(s)
  • 37102-74-2
InChIKey IBFJDBNISOJRCW-UHFFFAOYSA-N
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