(4-Bromophenyl)[4-({(2E)-4-[Cyclopropyl(Methyl)Amino]But-2-Enyl}Oxy)Phenyl]Methanone

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Properties Simple | Detailed

Formula C21H22BrNO2
IUPAC Name (4-bromophenyl)-[4-[(e)-4-[cyclopropyl(methyl)amino]but-2-enoxy]phenyl]methanone
Molecular Mass 400.309 g·mol−1
Heat of Formation 63.8 ± 16.7 kJ·mol−1
Dipole Moment 4.43 ± 1.08 D
Volume 444.07 Å 3
Surface Area 406.13 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.20 ± eV
Point Group Symmetry C1
Synonyms
  • (4-bromophenyl)-[4-[(e)-4-(cyclopropyl-methyl-amino)but-2-enoxy]phenyl]methanone
  • (4-bromophenyl)-[4-[(e)-4-(cyclopropyl-methylamino)but-2-enoxy]phenyl]methanone
  • r88
InChIKey JAZMZJDLZUDIDG-NSCUHMNNSA-N
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Elements H C Br O N