(2R)-2,4-Diethyl-5-Hydroxy-2-[(1E)-2-Methyl-1,3-Butadien-1-Yl]-3(2H)-Thiophenone

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Formula C13H18O2S
IUPAC Name (2r)-2,4-diethyl-5-hydroxy-2-[(1e)-2-methylbuta-1,3-dienyl]thiophen-3-one
Molecular Mass 238.346 g·mol−1
Heat of Formation -268.2 ± 16.7 kJ·mol−1
Dipole Moment 1.67 ± 1.08 D
Volume 304.6 Å 3
Surface Area 266.15 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2,4-diethyl-5-hydroxy-2-[(1e)-2-methylbuta-1,3-dienyl]-3-thiophenone
  • (2r)-2,4-diethyl-5-hydroxy-2-[(1e)-2-methylbuta-1,3-dienyl]thiophen-3-one
  • (r-(e))-3,5-diethyl-4-hydroxy-5-(2-methyl-1,3-butadienyl)-2(5h)-thiophenone
  • 2(5h)-thiophenone, 3,5-diethyl-4-hydroxy-5-(2-methyl-1,3-butadienyl)-, (r-(e))-
  • antibiotic om 674
  • thiotetromycin
CAS Number(s)
  • 85263-97-4
InChIKey KDRQPAVHKKVXSL-MMQHEFTJSA-N
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