1-Bromo-4-Tert-Butylbenzene

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Properties Simple | Detailed

Formula C10H13Br
IUPAC Name 1-bromo-4-tert-butyl-benzene
Molecular Mass 213.114 g·mol−1
Heat of Formation 6.9 ± 16.7 kJ·mol−1
Dipole Moment 2.81 ± 1.08 D
Volume 221.96 Å 3
Surface Area 209.15 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.07 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-bromo-4-(1,1-dimethylethyl)benzene
  • benzene, 1-bromo-4-(1,1-dimethylethyl)-
  • benzene, 1-bromo-4-tert-butyl-
CAS Number(s)
  • 3972-65-4
InChIKey XHCAGOVGSDHHNP-UHFFFAOYSA-N
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Elements H C Br