4-(2,5-Dichloro-3-Thienyl)-2-Pyrimidinamine

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Properties Simple | Detailed

Formula C8H5Cl2N3S
IUPAC Name 4-(2,5-dichloro-3-thienyl)pyrimidin-2-amine
Molecular Mass 246.116 g·mol−1
Heat of Formation 239.3 ± 16.7 kJ·mol−1
Dipole Moment 0.53 ± 1.08 D
Volume 244.53 Å 3
Surface Area 233.28 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 1.77 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(2,5-dichloro-thiophen-3-yl)-pyrimidin-2-ylamine
  • 4-(2,5-dichlorothien-3-yl)pyrimidin-2-amine
  • 4-(2,5-dichlorothiophen-3-yl)pyrimidin-2-amine
  • [4-(2,5-dichloro-3-thienyl)pyrimidin-2-yl]amine
  • ck1
InChIKey PAPYICJQRHSQGK-UHFFFAOYSA-N
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Elements H C N S Cl