(1R,2R)-1-(2,5-Dimethoxyphenyl)-2-(Isopropylamino)-1-Propanol

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Properties Simple | Detailed

Formula C14H23NO3
IUPAC Name (1r,2r)-1-(2,5-dimethoxyphenyl)-2-(isopropylamino)propan-1-ol
Molecular Mass 253.337 g·mol−1
Heat of Formation -499.8 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 335.62 Å 3
Surface Area 294.33 Å 2
HOMO Energy -8.27 ± 0.55 eV
LUMO Energy 0.11 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r)-1-(2,5-dimethoxyphenyl)-2-(isopropylamino)propan-1-ol
  • (1r,2r)-1-(2,5-dimethoxyphenyl)-2-(propan-2-ylamino)propan-1-ol
InChIKey YZXKGCIDSYWQIV-YGRLFVJLSA-N
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