(2S)-1-(1,3-Benzodioxol-5-Yl)-N-Methyl-2-Propanamine

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Properties Simple | Detailed

Formula C11H15NO2
IUPAC Name (2s)-1-(1,3-benzodioxol-5-yl)-n-methyl-propan-2-amine
Molecular Mass 193.242 g·mol−1
Heat of Formation -218.8 ± 16.7 kJ·mol−1
Dipole Moment 2.32 ± 1.08 D
Volume 244.07 Å 3
Surface Area 229.79 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 3.25 ± eV
Point Group Symmetry C1
Synonyms
  • pdsp1_001409
  • pdsp2_001393
InChIKey SHXWCVYOXRDMCX-QMMMGPOBSA-N
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