4-{(2S,3S)-3-Methyl-5-[(1E)-1-Propen-1-Yl]-2,3-Dihydro-1-Benzofuran-2-Yl}Phenol

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Properties Simple | Detailed

Formula C18H18O2
IUPAC Name 4-[(2s,3s)-3-methyl-5-[(e)-prop-1-enyl]-2,3-dihydrobenzofuran-2-yl]phenol
Molecular Mass 266.334 g·mol−1
Heat of Formation -159.3 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 334.32 Å 3
Surface Area 306.03 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy 0.03 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(2s,3s)-3-methyl-5-[(e)-prop-1-enyl]-2,3-dihydro-1-benzofuran-2-yl]phenol
  • 4-[(2s,3s)-3-methyl-5-[(e)-prop-1-enyl]-2,3-dihydrobenzofuran-2-yl]phenol
InChIKey GXJSAHXNLJFDPO-OFXNJDNMSA-N
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