(2E)-3-[2-(1-Octyn-1-Yl)Phenyl]Acrylic Acid

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Properties Simple | Detailed

Formula C17H20O2
IUPAC Name (e)-3-(2-oct-1-ynylphenyl)prop-2-enoic acid
Molecular Mass 256.339 g·mol−1
Heat of Formation -141.7 ± 16.7 kJ·mol−1
Dipole Moment 2.10 ± 1.08 D
Volume 347.44 Å 3
Surface Area 331.9 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy 2.13 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(2-oct-1-ynylphenyl)acrylic acid
  • (e)-3-(2-oct-1-ynylphenyl)prop-2-enoic acid
InChIKey KRDSGPLHVQJFLM-BUHFOSPRSA-N
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Elements H C O