[(3R)-3-(4-Chlorophenyl)-3-(2-Pyridinyl)Propyl]Dimethylamine Oxide

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Properties Simple | Detailed

Formula C16H21ClN2O+
IUPAC Name (3r)-3-(4-chlorophenyl)-n,n-dimethyl-3-(3h-pyridin-1-ium-3-id-2-yl)propan-1-amine oxide
Molecular Mass 292.804 g·mol−1
Heat of Formation 145.8 ± 16.7 kJ·mol−1
Dipole Moment 6.87 ± 1.08 D
Volume 358.04 Å 3
Surface Area 315.43 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-3-(4-chlorophenyl)-n,n-dimethyl-3-(2-pyridyl)propan-1-amine oxide
  • (3r)-3-(4-chlorophenyl)-n,n-dimethyl-3-pyridin-2-yl-propan-1-amine oxide
  • (3r)-3-(4-chlorophenyl)-n,n-dimethyl-3-pyridin-2-ylpropan-1-amine oxide
  • 2-p-chloro-alpha-(2-dimethylaminoethyl)-benzylpyridine n-oxide
  • 2-pyridinepropanamine, gamma-(4-chlorophenyl)-n,n-dimethyl-, n-oxide, (r)-
  • chlorpheniramine n-oxide
CAS Number(s)
  • 142494-45-9
InChIKey NMEICKDXQPVPKK-OAHLLOKOSA-N
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Elements H C N O Cl