(2R,4E)-5-(5-Isopropoxy-3-Pyridinyl)-N-Methyl-4-Penten-2-Amine

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Properties Simple | Detailed

Formula C14H23N2O
IUPAC Name (e,2r)-5-(5-isopropoxypyridin-1-ium-3-id-3-yl)-n-methyl-pent-4-en-2-amine
Molecular Mass 235.345 g·mol−1
Heat of Formation -98.6 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 323.47 Å 3
Surface Area 301.69 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -0.37 ± eV
Point Group Symmetry C1
Synonyms
  • (e,2r)-5-(5-isopropoxy-3-pyridyl)-n-methyl-pent-4-en-2-amine
  • (e,2r)-5-(5-isopropoxy-3-pyridyl)-n-methylpent-4-en-2-amine
  • (e,2r)-n-methyl-5-(5-propan-2-yloxypyridin-3-yl)pent-4-en-2-amine
  • [(e,1r)-4-(5-isopropoxy-3-pyridyl)-1-methyl-but-3-enyl]-methyl-amine
InChIKey RPCVIAXDAUMJJP-HOSRBBHYSA-N
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