5-{4-[(3,5-Difluorobenzyl)Amino]Phenyl}-6-Ethyl-2,4-Pyrimidinediamine

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Formula C19H19F2N5
IUPAC Name 5-[4-[(3,5-difluorophenyl)methylamino]phenyl]-6-ethyl-pyrimidine-2,4-diamine
Molecular Mass 355.384 g·mol−1
Heat of Formation -131.0 ± 16.7 kJ·mol−1
Dipole Moment 2.35 ± 1.08 D
Volume 415.04 Å 3
Surface Area 370.59 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[4-[(3,5-difluorophenyl)methylamino]phenyl]-6-ethylpyrimidine-2,4-diamine
  • 5-{4-[(3,5-difluorobenzyl)amino]phenyl}-6-ethylpyrimidine-2,4-diamine
  • 7ig
  • [4-(2,4-diamino-6-ethyl-pyrimidin-5-yl)phenyl]-(3,5-difluorobenzyl)amine
InChIKey SRRWXMSVQYQCRX-UHFFFAOYSA-N
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Elements H C F N