(6Z)-6-[4-(Hydroxymethyl)-1,3-Thiazol-2(3H)-Ylidene]-2,4-Cyclohexadien-1-One

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Properties Simple | Detailed

Formula C10H9NO2S
IUPAC Name (6z)-6-[4-(hydroxymethyl)thiazol-2-ylidene]cyclohexa-2,4-dien-1-one
Molecular Mass 207.249 g·mol−1
Heat of Formation -116.7 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 223.74 Å 3
Surface Area 217.52 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy 2.11 ± eV
Point Group Symmetry C1
Synonyms
  • (6z)-6-(4-methylol-3h-thiazol-2-ylidene)cyclohexa-2,4-dien-1-one
  • (6z)-6-[4-(hydroxymethyl)-3h-1,3-thiazol-2-ylidene]cyclohexa-2,4-dien-1-one
  • (6z)-6-[4-(hydroxymethyl)-3h-thiazol-2-ylidene]-1-cyclohexa-2,4-dienone
  • (6z)-6-[4-(hydroxymethyl)-3h-thiazol-2-ylidene]cyclohexa-2,4-dien-1-one
  • 2-(2'-hydroxyphenyl)-4-hydroxymethylthiazole
  • 4-thiazolemethanol, 2-(2-hydroxyphenyl)-
  • aeruginol
CAS Number(s)
  • 154037-50-0
InChIKey OJUVKTKVBLPUIK-NTMALXAHSA-N
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