4-Bromobutanoic Acid

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Properties Simple | Detailed

Formula C4H7BrO2
IUPAC Name 4-bromobutanoic acid
Molecular Mass 167.001 g·mol−1
Heat of Formation -445.3 ± 16.7 kJ·mol−1
Dipole Moment 2.87 ± 1.08 D
Volume 146.9 Å 3
Surface Area 155.8 Å 2
HOMO Energy -10.31 ± 0.55 eV
LUMO Energy 3.29 ± eV
Point Group Symmetry Cs
Synonyms
  • 4-bromo-n-butyric acid
  • 4-bromobutyric acid
  • butanoic acid, 4-bromo-
  • butyric acid, 4-bromo-
CAS Number(s)
  • 2623-87-2
InChIKey GRHQDJDRGZFIPO-UHFFFAOYSA-N
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Elements H C Br O