(2E)-2-Cyano-3-(3,4-Dihydroxyphenyl)Acrylic Acid

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Properties Simple | Detailed

Formula C10H7NO4
IUPAC Name (e)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
Molecular Mass 205.167 g·mol−1
Heat of Formation -445.4 ± 16.7 kJ·mol−1
Dipole Moment 3.60 ± 1.08 D
Volume 229.62 Å 3
Surface Area 223.1 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy -1.91 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-2-cyano-3-(3,4-dihydroxyphenyl)-2-propenoic acid
  • (e)-2-cyano-3-(3,4-dihydroxyphenyl)acrylic acid
  • (e)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
  • 2-cyano-3-(3,4-dihydroxyphenyl)acrylic acid
  • 2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
  • 2-propenoic acid, 2-cyano-3-(3,4-dihydroxyphenyl)-, (2e)-
  • 2-propenoic acid, 2-cyano-3-(3,4-dihydroxyphenyl)-, (2e)- (9ci)
  • 2-propenoic acid, 2-cyano-3-(3,4-dihydroxyphenyl)-, (e)-
  • ag-30
  • alpha-cyano-3,4-dihydroxycinnamic acid
  • bbv-032857
  • benzylidenemalononitrile (bmn) deriv. 36
  • tyrophostin ag 30
CAS Number(s)
  • 122520-79-0
InChIKey CJMWBHLWSMKFSM-XVNBXDOJSA-N
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