5-[4-(1-Piperidinyl)Butoxy]-3,4-Dihydro-1(2H)-Isoquinolinone

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Properties Simple | Detailed

Formula C18H26N2O2
IUPAC Name 5-[4-(1-piperidyl)butoxy]-3,4-dihydro-2h-isoquinolin-1-one
Molecular Mass 302.411 g·mol−1
Heat of Formation -318.8 ± 16.7 kJ·mol−1
Dipole Moment 6.55 ± 1.08 D
Volume 384.84 Å 3
Surface Area 352.46 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy 2.64 ± eV
Point Group Symmetry C1
InChIKey RVOUDNBEIXGHJY-UHFFFAOYSA-N
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