T-Butylacetylene

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Properties Simple | Detailed

Formula C6H10
IUPAC Name 3,3-dimethylbut-1-yne
Molecular Mass 82.144 g·mol−1
Heat of Formation 126.3 ± 16.7 kJ·mol−1
Dipole Moment 0.98 ± 1.08 D
Volume 85.77 Å 3
Surface Area 91.58 Å 2
HOMO Energy -10.69 ± 0.55 eV
LUMO Energy 4.73 ± eV
Point Group Symmetry C3v
Synonyms
  • 1-butyne, 3,3-dimethyl-
  • 3,3-dimethyl-1-butyne
  • 3,3-dimethylbutyne
  • tert-butylacetylene
CAS Number(s)
  • 917-92-0
InChIKey PPWNCLVNXGCGAF-UHFFFAOYSA-N
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Elements H C