2-(4-Aminobutyl)-1,3-Propanediol

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Properties Simple | Detailed

Formula C7H17NO2
IUPAC Name 2-(4-aminobutyl)propane-1,3-diol
Molecular Mass 147.215 g·mol−1
Heat of Formation -464.0 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 205.38 Å 3
Surface Area 203.79 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy 2.61 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-propanediol, 2-(4-aminobutyl)-
  • 2-(4-aminobut-1-yl)-1,3-propanediol
  • apd linker
CAS Number(s)
  • 125162-81-4
InChIKey KUZCSLNRDJKKMK-UHFFFAOYSA-N
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