2-Methyl-3-Buten-2-Yl (2E)-3-(3,4-Dihydroxyphenyl)Acrylate

Molecule SVG Image

Properties Simple | Detailed

Formula C14H16O4
IUPAC Name 1,1-dimethylallyl (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Molecular Mass 248.274 g·mol−1
Heat of Formation -563.7 ± 16.7 kJ·mol−1
Dipole Moment 4.17 ± 1.08 D
Volume 305.36 Å 3
Surface Area 287.77 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(3,4-dihydroxyphenyl)acrylic acid 1,1-dimethylprop-2-enyl ester
  • (e)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid 1,1-dimethylprop-2-enyl ester
  • 1,1-dimethylallyl-3',4'-dihydroxycinnamic acid ester
  • 1,1-dimethylprop-2-enyl (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
  • 2-methylbut-3-en-2-yl (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
  • 2-propenoic acid, 3-(3,4-dihydroxyphenyl)-, 1,1-dimethyl-2-propenyl ester
  • ddcae
CAS Number(s)
  • 121496-68-2
InChIKey YNXBINXRYLBWOT-SOFGYWHQSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O