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

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Properties Simple | Detailed

Formula C12H15IN2O5++
IUPAC Name 1-[(2r,3r,5s)-3-hydroxy-5-[[(e)-2-iodovinyloxy]methyl]tetrahydrofuran-2-yl]-3-methyl-pyrimidine-2,4-dione
Molecular Mass 394.162 g·mol−1
Heat of Formation -703.0 ± 16.7 kJ·mol−1
Dipole Moment 4.67 ± 1.08 D
Volume 347.91 Å 3
Surface Area 306.09 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,3r,5s)-3-hydroxy-5-[[(e)-2-iodoethenoxy]methyl]-2-tetrahydrofuranyl]-3-methylpyrimidine-2,4-dione
  • 1-[(2r,3r,5s)-3-hydroxy-5-[[(e)-2-iodoethenoxy]methyl]oxolan-2-yl]-3-methyl-pyrimidine-2,4-dione
  • 1-[(2r,3r,5s)-3-hydroxy-5-[[(e)-2-iodoethenoxy]methyl]oxolan-2-yl]-3-methylpyrimidine-2,4-dione
  • 1-[(2r,3r,5s)-3-hydroxy-5-[[(e)-2-iodoethenoxy]methyl]tetrahydrofuran-2-yl]-3-methyl-pyrimidine-2,4-dione
  • 1-[(2r,3r,5s)-3-hydroxy-5-[[(e)-2-iodoethenoxy]methyl]tetrahydrofuran-2-yl]-3-methyl-pyrimidine-2,4-quinone
  • 3-ch3-ivdu
  • 3-methyl-5-(2-iodovinyl)-2'-deoxyuridine
CAS Number(s)
  • 118068-34-1
InChIKey HWWDFMZUSXVHAP-NCDMNOEPSA-N
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