3-Amino-1-(2-Amino-5-Hydroxyphenyl)-1-Propanone

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Properties Simple | Detailed

Formula C9H12N2O2
IUPAC Name 3-amino-1-(2-amino-5-hydroxy-phenyl)propan-1-one
Molecular Mass 180.204 g·mol−1
Heat of Formation -269.8 ± 16.7 kJ·mol−1
Dipole Moment 4.48 ± 1.08 D
Volume 216.61 Å 3
Surface Area 212.88 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy 2.26 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-amino-1-(2-amino-5-hydroxyphenyl)propan-1-one
  • 5-hydroxykynuramine
  • 5-hydroxykynurenamine
  • mausamine
  • mousamine
CAS Number(s)
  • 708-23-6
InChIKey JANBBPTXDKFOQR-UHFFFAOYSA-N
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