4,4'-[(2S,3R)-2,3-Pentanediyl]Diphenol

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Properties Simple | Detailed

Formula C17H20O2
IUPAC Name 4-[(1s,2r)-2-(4-hydroxyphenyl)-1-methyl-butyl]phenol
Molecular Mass 256.339 g·mol−1
Heat of Formation -297.8 ± 16.7 kJ·mol−1
Dipole Moment 0.08 ± 1.08 D
Volume 336.06 Å 3
Surface Area 290.97 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 0.05 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(1r,2s)-1-ethyl-2-(4-hydroxyphenyl)propyl]phenol
  • 4-[(2s,3r)-2-(4-hydroxyphenyl)pentan-3-yl]phenol
  • erythro-4,4'-(1-ethyl-2-methylethylene)diphenol
  • erythro-alpha-ethyl-alpha'-methyl-4,4'-dihydroxybibenzyl
  • erythro-ethyl-alpha'-methyl-4,4'-dihydroxybibenzyl
  • erythro-mea
  • phenol, 4,4'-(1-ethyl-2-methylethylene)di-, erythro-
CAS Number(s)
  • 20576-52-7
InChIKey PYYFTORPKDTZJF-SJKOYZFVSA-N
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