8-(4-Hydroxybutyl)Thieno[3,2-C][1]Benzoxepin-10(4H)-One

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Properties Simple | Detailed

Formula C16H16O3S
IUPAC Name 8-(4-hydroxybutyl)-4h-thieno[3,2-c][1]benzoxepin-10-one
Molecular Mass 288.361 g·mol−1
Heat of Formation -320.1 ± 16.7 kJ·mol−1
Dipole Moment 5.33 ± 1.08 D
Volume 333.57 Å 3
Surface Area 307.06 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(4,10-dihydro-10-oxothieno(3,2-c)(1)-benzoxepin-8-yl)butanol
  • 4-dobbo
  • 8-(4-hydroxybutyl)-4h-thieno[3,2-c][1]benzoxepin-10-one
  • hp-573
  • thieno(3,2-c)(1)benzoxepin-10(4h)-one, 8-(4-hydroxybutyl)-
CAS Number(s)
  • 86223-08-7
InChIKey IPHKVWAKDXKJRE-UHFFFAOYSA-N
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