3,3'-[(3R,4R)-3,4-Hexanediyl]Diphenol

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Properties Simple | Detailed

Formula C18H22O2
IUPAC Name 3-[(1r,2r)-1-ethyl-2-(3-hydroxyphenyl)butyl]phenol
Molecular Mass 270.366 g·mol−1
Heat of Formation -328.3 ± 16.7 kJ·mol−1
Dipole Moment 1.18 ± 1.08 D
Volume 359.42 Å 3
Surface Area 295.07 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy 0.24 ± eV
Point Group Symmetry C2
Synonyms
  • 3,3'-ddde
  • 3,3'-dihydroxy-alpha,beta-diethyldiphenylethane
  • 3-[(1r,2r)-1-ethyl-2-(3-hydroxyphenyl)butyl]phenol
  • 3-[(3r,4r)-4-(3-hydroxyphenyl)hexan-3-yl]phenol
  • phenol, 3,3'-(1,2-diethyl-1,2-ethanediyl)bis-, (r*,r*)-
CAS Number(s)
  • 114884-46-7
InChIKey KUJAWCSIKNKXLL-ROUUACIJSA-N
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