2-Chloro-6-[(2R)-2-Hydroxy-3-{[2-Methyl-1-(2-Naphthyl)-2-Propanyl]Amino}Propoxy]Benzonitrile

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Formula C24H25ClN2O2
IUPAC Name 2-chloro-6-[(2r)-3-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-2-hydroxy-propoxy]benzonitrile
Molecular Mass 408.921 g·mol−1
Heat of Formation -116.5 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 498.18 Å 3
Surface Area 365.65 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -1.32 ± eV
Point Group Symmetry C1
Synonyms
  • 2-chloro-6-[(2r)-2-hydroxy-3-[(2-methyl-1-naphthalen-2-yl-propan-2-yl)amino]propoxy]benzonitrile
  • 2-chloro-6-[(2r)-2-hydroxy-3-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]propoxy]benzonitrile
  • 2-chloro-6-[(2r)-3-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-2-hydroxy-propoxy]benzonitrile
  • 2-chloro-6-[(2r)-3-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-2-hydroxypropoxy]benzonitrile
  • nps-2143
  • sb-262470
InChIKey PZUJQWHTIRWCID-HXUWFJFHSA-N
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Elements H C N O Cl