5-Propyl-1,3-Benzodioxole

Molecule SVG Image

Properties Simple | Detailed

Formula C10H12O2
IUPAC Name 5-propyl-1,3-benzodioxole
Molecular Mass 164.201 g·mol−1
Heat of Formation -243.4 ± 16.7 kJ·mol−1
Dipole Moment 0.53 ± 1.08 D
Volume 204.94 Å 3
Surface Area 202.9 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.24 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-(methylenedioxy)-4-propylbenzene
  • 1,3-benzodioxole, 5-propyl-
  • 2',3'-dihydrosafrole
  • 4-propyl-1,2-(methylenedioxy)benzene
  • 4-propyl-1,2-methylenedioxybenzene
  • [1,2-(methylenedioxy)-4-propyl]benzene
  • benzene, 1,2-(methylenedioxy)-4-propyl-
  • benzene, 1,2-methylenedioxy-4-propyl-
  • dihydroisosafrole
  • dihydrosafrol
  • dihydrosafrole
  • safrole, dihydro-
CAS Number(s)
  • 94-58-6
InChIKey MYEIDJPOUKASEC-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O