4-Tert-Butylphenylacetylene

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Properties Simple | Detailed

Formula C12H14
IUPAC Name 1-tert-butyl-4-ethynyl-benzene
Molecular Mass 158.240 g·mol−1
Heat of Formation 229.1 ± 16.7 kJ·mol−1
Dipole Moment 1.44 ± 1.08 D
Volume 226.96 Å 3
Surface Area 214.82 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-tert-butyl-4-ethynylbenzene
InChIKey ZSYQVVKVKBVHIL-UHFFFAOYSA-N
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Elements H C