3-(8-Cyclopentyl-2,6-Dioxo-1-Propyl-1,2,6,7-Tetrahydro-3H-Purin-3-Yl)Propyl 4-(Fluorosulfonyl)Benzoate

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Properties Simple | Detailed

Formula C23H27FN4O6S
IUPAC Name 3-(8-cyclopentyl-2,6-dioxo-1-propyl-7h-purin-3-yl)propyl 4-fluorosulfonylbenzoate
Molecular Mass 506.547 g·mol−1
Heat of Formation 2643.6 ± 16.7 kJ·mol−1
Dipole Moment 2.40 ± 1.08 D
Volume 503.13 Å 3
Surface Area 466.14 Å 2
Point Group Symmetry C1
Synonyms
  • 4-fluorosulfonylbenzoic acid 3-(8-cyclopentyl-2,6-diketo-1-propyl-7h-purin-3-yl)propyl ester
  • 4-fluorosulfonylbenzoic acid 3-(8-cyclopentyl-2,6-dioxo-1-propyl-7h-purin-3-yl)propyl ester
  • 8-cyclopentyl-3-(3-((4-(fluorosulfonyl)benzoyl)oxy)propyl)-1-propylxanthine
  • 8-cyclopentyl-n3-[3-(4-(fluorosulfonyl)benzoyloxy)propyl]-n1-propylxanthine
  • fscpx
  • fscpx xanthine
CAS Number(s)
  • 156547-56-7
InChIKey XJLGXHIRSHTRPQ-UHFFFAOYSA-N
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