5-(2,3-Dichlorophenyl)-6-(Fluoromethyl)-2,4-Pyrimidinediamine

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Properties Simple | Detailed

Formula C11H9Cl2FN4
IUPAC Name 5-(2,3-dichlorophenyl)-6-(fluoromethyl)pyrimidine-2,4-diamine
Molecular Mass 287.120 g·mol−1
Heat of Formation -53.0 ± 16.7 kJ·mol−1
Dipole Moment 3.15 ± 1.08 D
Volume 295.15 Å 3
Surface Area 262.64 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 2.27 ± eV
Point Group Symmetry C1
Synonyms
  • [2-amino-5-(2,3-dichlorophenyl)-6-(fluoromethyl)pyrimidin-4-yl]amine
InChIKey GKBLWFDYSYTVEA-UHFFFAOYSA-N
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Elements H N F C Cl