(S)-3-Ethyl-2-(4-Hydroxyphenyl)-1-Methyl-1H-Inden-6-Ol

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Properties Simple | Detailed

Formula C18H18O2
IUPAC Name (3s)-1-ethyl-2-(4-hydroxyphenyl)-3-methyl-3h-inden-5-ol
Molecular Mass 266.334 g·mol−1
Heat of Formation -203.1 ± 16.7 kJ·mol−1
Dipole Moment 2.08 ± 1.08 D
Volume 336.26 Å 3
Surface Area 293.12 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy 2.90 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-3-ethyl-2-(4-hydroxyphenyl)-1-methyl-1h-inden-6-ol
  • (s)-indenestrol a
  • 1h-inden-6-ol, 3-ethyl-2-(4-hydroxy(phenyl)-1-methyl-, (s)-
CAS Number(s)
  • 115217-04-4
InChIKey BBOUFHMHCBZYJJ-NSHDSACASA-N
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DOI
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Elements H C O