Benzcyclan

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Properties Simple | Detailed

Formula C19H31NO
IUPAC Name 3-(1-benzylcycloheptoxy)-n,n-dimethyl-propan-1-amine
Molecular Mass 289.456 g·mol−1
Heat of Formation -212.4 ± 16.7 kJ·mol−1
Dipole Moment 0.97 ± 1.08 D
Volume 400.38 Å 3
Surface Area 335.77 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C1
Synonyms
  • 1-propanamine, n,n-dimethyl-3-((1-(phenylmethyl)cycloheptyl)oxy)-
  • 1-propanamine, n,n-dimethyl-3-[[1-(phenylmethyl)cycloheptyl]oxy]-
  • 3-((1-benzylcycloheptyl)oxy)-n,n-dimethylpropylamin
  • 3-[1-(benzyl)cycloheptoxy]propyl-dimethyl-amine
  • bencyclane
  • n,n-dimethyl-3-[1-(phenylmethyl)cycloheptoxy]propan-1-amine
  • n,n-dimethyl-3-[1-(phenylmethyl)cycloheptyl]oxy-propan-1-amine
  • n,n-dimethyl-3-[1-(phenylmethyl)cycloheptyl]oxypropan-1-amine
  • n,n-dimethyl-3-{[1-(phenylmethyl)cycloheptyl]oxy}propan-1-amine
CAS Number(s)
  • 2179-37-5
InChIKey FYJJXENSONZJRG-UHFFFAOYSA-N
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