1-Chloro-3,3-Dimethylbutane

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Properties Simple | Detailed

Formula C6H13Cl
IUPAC Name 1-chloro-3,3-dimethyl-butane
Molecular Mass 120.620 g·mol−1
Heat of Formation -198.4 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 168.67 Å 3
Surface Area 165.21 Å 2
HOMO Energy -10.73 ± 0.55 eV
LUMO Energy 0.65 ± eV
Point Group Symmetry Cs
Synonyms
  • butane, 1-chloro-3,3-dimethyl-
  • neohexyl chloride
CAS Number(s)
  • 2855-08-5
InChIKey XGCKOSFYXBAPQM-UHFFFAOYSA-N
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Elements H C Cl