3-Iodopropyl Trifluoromethanesulfonate

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Properties Simple | Detailed

Formula C4H8F3IO3S
IUPAC Name 3-iodopropyl trifluoromethanesulfonate
Molecular Mass 320.069 g·mol−1
Heat of Formation -1101.3 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 228.4 Å 3
Surface Area 220.35 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry C1
Synonyms
  • 3-iodopropyl-1-triflate
  • 3-iodopropyl-1-trifluoromethanesulfonate
  • trifluoromethanesulfonic acid 3-iodopropyl ester
CAS Number(s)
  • 106114-40-3
InChIKey FMSOAEQMFVDTSC-UHFFFAOYSA-N
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