Crotafuran E

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Properties Simple | Detailed

Formula C20H18O6
IUPAC Name crotafuran e
Molecular Mass 354.353 g·mol−1
Heat of Formation -760.0 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 391.34 Å 3
Surface Area 344.12 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-propanediol, 2-[(5br,11br)-5b,11b-dihydro-9-hydroxy-6h-furo[2',3':6,7]benzofuro[3,2-c][1]benzopyran-2-yl]-, (2r)-
  • 2-(9-hydroxy-5b,11b-dihydro-6h-3,7,12-trioxa-benzo[a]cyclopenta[i]fluoren-2-yl)-propane-1,2-diol
  • 5'-(1-methyl-1,2-dihydroxyethyl)-furo[2',3':9,10]pterocarpan-3-ol
  • 5?-(1-methyl-1,2-dihydroxyethyl)-furo[2?,3?:9,10]pterocarpan-3-ol
  • rel-(2r)-2-[(5br,11br)-9-hydroxy-5b,11b-dihydro-6h-furo[2',3':6,7][1]benzofuro[3,2-c]chromen-2-yl]propane-1,2-diol
InChIKey JDKOSPKTKADBCU-PNHOKKKMSA-N
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