Methyl 2-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-Propenoyl]Amino}-5-Hydroxybenzoate

Molecule SVG Image

Properties Simple | Detailed

Formula C17H15NO6
IUPAC Name methyl 2-[[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]amino]-5-hydroxy-benzoate
Molecular Mass 329.304 g·mol−1
Heat of Formation -808.8 ± 16.7 kJ·mol−1
Dipole Moment 3.65 ± 1.08 D
Volume 368.19 Å 3
Surface Area 346.43 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[[(e)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enyl]amino]-5-hydroxybenzoic acid methyl ester
  • 2-[[(e)-3-(3,4-dihydroxyphenyl)acryloyl]amino]-5-hydroxy-benzoic acid methyl ester
  • methyl 2-[[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]amino]-5-hydroxy-benzoate
InChIKey IUZHCICFVDHVMC-XVNBXDOJSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N