2-Methyl-2-Butanethiol

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Properties Simple | Detailed

Formula C5H12S
IUPAC Name 2-methylbutane-2-thiol
Molecular Mass 104.214 g·mol−1
Heat of Formation -122.8 ± 16.7 kJ·mol−1
Dipole Moment 2.37 ± 1.08 D
Volume 151.69 Å 3
Surface Area 149.56 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy 2.90 ± eV
Point Group Symmetry C1
Synonyms
  • 2-butanethiol, 2-methyl-
  • 2-methybutane-2-thiol
  • 2-tert-pentyl mercaptan
  • tert-amyl mercaptan
  • tert-pentyl mercaptan
CAS Number(s)
  • 1679-09-0
InChIKey IQIBYAHJXQVQGB-UHFFFAOYSA-N
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Elements H C S