2-Cyanocinnamic Acid

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Properties Simple | Detailed

Formula C10H7NO2
IUPAC Name (e)-3-(2-cyanophenyl)prop-2-enoic acid
Molecular Mass 173.168 g·mol−1
Heat of Formation -86.9 ± 16.7 kJ·mol−1
Dipole Moment 5.05 ± 1.08 D
Volume 209.6 Å 3
Surface Area 207.78 Å 2
HOMO Energy -10.49 ± 0.55 eV
LUMO Energy -1.39 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(2-cyanophenyl)acrylic acid
  • (e)-3-(2-cyanophenyl)prop-2-enoic acid
  • 3-(2-cyanophenyl)acrylic acid
  • 3-(2-cyanophenyl)prop-2-enoic acid
CAS Number(s)
  • 61147-65-7
InChIKey HQVOPXGNHGTKOD-AATRIKPKSA-N
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