Methyl Gallate

Molecule SVG Image

Properties Simple | Detailed

Formula C8H8O5
IUPAC Name methyl 3,4,5-trihydroxybenzoate
Molecular Mass 184.146 g·mol−1
Heat of Formation -795.1 ± 16.7 kJ·mol−1
Dipole Moment 1.37 ± 1.08 D
Volume 199.04 Å 3
Surface Area 198.98 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry Cs
Synonyms
  • 3,4,5-trihydroxybenzoic acid methyl ester
  • benzoic acid, 3,4,5-trihydroxy-, methyl ester
  • gallic acid methyl ester
  • gallic acid, methyl ester
  • methylgallate
CAS Number(s)
  • 99-24-1
InChIKey FBSFWRHWHYMIOG-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O