3-[(2-Methyl-2-Propanyl)Oxy]-1-Butyne

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Properties Simple | Detailed

Formula C8H14O
IUPAC Name (3r)-3-tert-butoxybut-1-yne
Molecular Mass 126.196 g·mol−1
Heat of Formation -64.7 ± 16.7 kJ·mol−1
Dipole Moment 1.10 ± 1.08 D
Volume 188.54 Å 3
Surface Area 182.33 Å 2
HOMO Energy -9.91 ± 0.55 eV
LUMO Energy 0.98 ± eV
Point Group Symmetry C1
InChIKey FIQFHOBKZSUGLM-SSDOTTSWSA-N
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Elements H C O