N-[(2E)-2-(3-Hydroxy-4-Oxo-2,5-Cyclohexadien-1-Ylidene)Ethyl]Acetamide

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Formula C10H11NO3
IUPAC Name n-[(2e)-2-(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethyl]acetamide
Molecular Mass 193.199 g·mol−1
Heat of Formation -343.9 ± 16.7 kJ·mol−1
Dipole Moment 1.99 ± 1.08 D
Volume 231.37 Å 3
Surface Area 227.89 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -1.52 ± eV
Point Group Symmetry C1
Synonyms
  • acetamide, n-(2-(3-hydroxy-4-oxo-2,5-cyclohexadien-1-ylidene)ethyl)-
  • n-(2-(3-hydroxy-4-oxo-2,5-cyclohexadien-1-ylidene)ethyl)acetamide
  • n-[(2e)-2-(3-hydroxy-4-keto-1-cyclohexa-2,5-dienylidene)ethyl]acetamide
  • n-[(2e)-2-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethyl]acetamide
  • n-[(2e)-2-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethyl]ethanamide
  • n-acetyldopamine quinone methide
  • nada quinone methide
CAS Number(s)
  • 117333-16-1
InChIKey HZUDLKIKKKYMQA-XBXARRHUSA-N
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