3-(4-Fluorobenzyl)-2-Thioxo-1,2,3,7-Tetrahydro-6H-Purin-6-One

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Properties Simple | Detailed

Formula C12H9FN4OS
IUPAC Name 3-[(4-fluorophenyl)methyl]-2-thioxo-7h-purin-6-one
Molecular Mass 276.289 g·mol−1
Heat of Formation 1568.3 ± 16.7 kJ·mol−1
Dipole Moment 5.28 ± 1.08 D
Volume 272.73 Å 3
Surface Area 252.5 Å 2
Point Group Symmetry Cs
Synonyms
  • 3-(4-fluorobenzyl)-2-thioxo-7h-purin-6-one
  • 3-[(4-fluorophenyl)methyl]-2-thioxo-7h-purin-6-one
InChIKey GMNQNGTVFNOHLD-UHFFFAOYSA-N
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