1-{2-[(4'-Cyano-4-Biphenylyl)Oxy]Ethyl}-3-Hydroxy-1-Methylurea

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Properties Simple | Detailed

Formula C17H17N3O3
IUPAC Name 1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]-3-hydroxy-1-methyl-urea
Molecular Mass 311.335 g·mol−1
Heat of Formation -89.0 ± 16.7 kJ·mol−1
Dipole Moment 6.56 ± 1.08 D
Volume 374.21 Å 3
Surface Area 338.71 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 3.08 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[2-[4-(4-cyanophenyl)phenoxy]ethyl]-3-hydroxy-1-methylurea
  • 2ni
  • n-{2-[(4'-cyano-1,1'-biphenyl-4-yl)oxy]ethyl}-n'-hydroxy-n-methylurea
InChIKey GVMUNGGWXRKCEU-UHFFFAOYSA-N
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