2'-Deoxy-5-[(E)-2-Iodovinyl]-3-Methyluridine

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Formula C12H15IN2O5++
IUPAC Name 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-[(e)-2-iodovinyl]-3-methyl-pyrimidine-2,4-dione
Molecular Mass 394.162 g·mol−1
Heat of Formation -746.1 ± 16.7 kJ·mol−1
Dipole Moment 4.44 ± 1.08 D
Volume 346.07 Å 3
Surface Area 307.56 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-[(e)-2-iodovinyl]-3-methylpyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-[(e)-2-iodoethenyl]-3-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-[(e)-2-iodovinyl]-3-methyl-pyrimidine-2,4-dione
  • 1-[(2r,4s,5r)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-5-[(e)-2-iodovinyl]-3-methyl-pyrimidine-2,4-quinone
InChIKey MJMQFCSOWLTHNK-YJCWOPNRSA-N
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