Osthole

Molecule SVG Image

Properties Simple | Detailed

Formula C15H17O3+
IUPAC Name 7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one
Molecular Mass 245.294 g·mol−1
Heat of Formation -364.6 ± 16.7 kJ·mol−1
Dipole Moment 5.51 ± 1.08 D
Volume 300.25 Å 3
Surface Area 272.54 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1-benzopyran-2-one, 7-methoxy-8-(3-methyl-2-butenyl)-
  • 2h-1-benzopyran-2-one, 7-methoxy-8-(3-methyl-2-butenyl)- (9ci)
  • 7-methoxy-8-(3-methyl-2-butenyl)-coumarin
  • 7-methoxy-8-(3-methyl-but-2-enyl)-chromen-2-one
  • 7-methoxy-8-(3-methylbut-2-en-1-yl)-2h-chromen-2-one
  • 7-methoxy-8-(3-methylbut-2-enyl)-2-chromenone
  • 7-methoxy-8-(3-methylbut-2-enyl)coumarin
  • 7-methoxy-8-isopentenylcoumarin
  • 8-(3-methyl-2-butenyl)herniarin
  • acon1_002155
  • bas 00015470
  • bb_nc-1338
  • coumarin, 7-methoxy-8-(3-methyl-2-butenyl)-
  • megxp0_000155
  • oprea1_642606
  • oprea1_873803
  • osthol
  • osthole isolated from scutellaria baicalensis
  • ostol
  • ostole
  • sdccgmls-0066780.p001
CAS Number(s)
  • 484-12-8
InChIKey MBRLOUHOWLUMFF-UHFFFAOYSA-N
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