G-Butyrobetaine

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Properties Simple | Detailed

Formula C7H15NO2
IUPAC Name 4-(trimethylammonio)butanoate
Molecular Mass 145.199 g·mol−1
Heat of Formation -221.7 ± 16.7 kJ·mol−1
Dipole Moment 23.36 ± 1.08 D
Volume 198.88 Å 3
Surface Area 194.04 Å 2
HOMO Energy -7.36 ± 0.55 eV
LUMO Energy 1.80 ± eV
Point Group Symmetry C1
Synonyms
  • 1-propanaminium, 3-carboxy-n,n,n-trimethyl-, hydroxide, inner salt (9ci)
  • 3-carboxy-n,n,n-trimethyl-1-propanaminium hydroxide inner salt
  • 4-(n-trimethylamino)butyrate
  • 4-butyrobetaine
  • 4-trimethylammoniobutanoate
  • 4-trimethylammoniobutyrate
  • 4-trimethylazaniumylbutanoate
  • actinine
  • ammonium, (3-carboxypropyl)trimethyl-, hydroxide, inner salt
  • butyrobetaine
  • deoxycarnitine
  • gamma-butyrobetain
  • gamma-butyrobetaine
  • n-trimethyl-gamma-aminobutyric acid
CAS Number(s)
  • 407-64-7
InChIKey JHPNVNIEXXLNTR-UHFFFAOYSA-N
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