Apiol

Molecule SVG Image

Properties Simple | Detailed

Formula C12H14O4
IUPAC Name 5-allyl-4,7-dimethoxy-1,3-benzodioxole
Molecular Mass 222.237 g·mol−1
Heat of Formation -429.9 ± 16.7 kJ·mol−1
Dipole Moment 2.50 ± 1.08 D
Volume 260.91 Å 3
Surface Area 248.13 Å 2
HOMO Energy -8.32 ± 0.55 eV
LUMO Energy -0.28 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-benzodioxole, 4,7-dimethoxy-5-(2-propenyl)-
  • 1-allyl-2,5-dimethoxy-3,4-(methylenedioxy)benzene
  • 1-allyl-2,5-dimethoxy-3,4-methylenedioxybenzene
  • 4,7-dimethoxy-5-prop-2-enyl-1,3-benzodioxole
  • 5-allyl-4,7-dimethoxy-1,3-benzodioxol
  • apiole
  • apiole (parsley)
  • apioline
  • benzene, 1-allyl-2,5-dimethoxy-3,4-(methylenedioxy)-
  • parsley apiol
  • parsley apiole
  • parsley camphor
  • petersiliencampher
  • zero/009048
CAS Number(s)
  • 83382-66-5
  • 523-80-8
InChIKey QQRSPHJOOXUALR-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O