4,4'-(2,3-Diisocyano-1,3-Butadiene-1,4-Diyl)Bisphenol

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Properties Simple | Detailed

Formula C18H14N2O2
IUPAC Name 4-[(1z,3z)-4-(4-hydroxyphenyl)-2,3-diisocyano-buta-1,3-dienyl]phenol
Molecular Mass 290.316 g·mol−1
Heat of Formation 331.2 ± 16.7 kJ·mol−1
Dipole Moment 0.09 ± 1.08 D
Volume 359.85 Å 3
Surface Area 327.04 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry Ci
Synonyms
  • 1,4-di-p-oxyphenyl-2,3-di-isonitrilo-1,3-butadien
  • 1,4-di-p-oxyphenyl-2,3-di-isonitrilo-1,3-butadiene
  • 4-[(1z,3z)-4-(4-hydroxyphenyl)-2,3-diisocyano-buta-1,3-dienyl]phenol
  • 4-[(1z,3z)-4-(4-hydroxyphenyl)-2,3-diisocyanobuta-1,3-dienyl]phenol
  • 4-[4-(4-hydroxyphenyl)-2,3-diisocyano-buta-1,3-dienyl]phenol
  • 4-[4-(4-hydroxyphenyl)-2,3-diisocyanobuta-1,3-dienyl]phenol
  • antibiotic obtained from cultures of penicillium notatum or the same substance produced by any other means
  • brevicid
  • brevicide
  • brevicide-x
  • ethylene isocyanide, bis(p-hydroxybenzylidene)-
  • ophthocillin
  • phenol, 4,4'-(2,3-diisocyano-1,3-butadiene-1,4-diyl)bis-
  • phenol, 4,4'-(2,3-diisocyano-1,3-butadiene-1,4-diyl)bis- (9ci)
  • trianthil
  • xanthocillin
  • xanthocillin (x)
  • xanthocillin x
  • xanthocillinum
  • xantocillin
  • xantyrid
CAS Number(s)
  • 580-74-5
  • 11042-38-9
InChIKey YBMVKDUTYAGKEW-WHYMJUELSA-N
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