2,2-Dimethyl-7-[3-(3-Phenylpropyl)-2-Thienyl]Heptanoic Acid

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Properties Simple | Detailed

Formula C22H30O2S
IUPAC Name 2,2-dimethyl-7-[3-(3-phenylpropyl)-2-thienyl]heptanoic acid
Molecular Mass 358.537 g·mol−1
Heat of Formation -440.7 ± 16.7 kJ·mol−1
Dipole Moment 1.47 ± 1.08 D
Volume 467.88 Å 3
Surface Area 365.94 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • 2,2-dimethyl-7-(3-(3-phenylpropyl)-2-thienyl)heptanoic acid
  • 2,2-dimethyl-7-[3-(3-phenylpropyl)-2-thienyl]enanthic acid
  • 2,2-dimethyl-7-[3-(3-phenylpropyl)thiophen-2-yl]heptanoic acid
  • 2-thiopheneheptanoic acid, alpha,alpha-dimethyl-3-(3-phenylpropyl)
  • rp 66153
  • rp-66153
CAS Number(s)
  • 142422-79-5
InChIKey QMXLXSYXJOJQSN-UHFFFAOYSA-N
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