2'-Deoxy-5-(Methoxymethyl)Uridine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C11H17N2O9P++
IUPAC Name [(2r,3s,5r)-3-hydroxy-5-[5-(methoxymethyl)-2,4-dioxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 352.234 g·mol−1
Heat of Formation -1899.1 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 365.66 Å 3
Surface Area 311.81 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
Synonyms
  • 5'-thymidylic acid, alpha-methoxy-
  • 5-methoxymethyl-2'-deoxyuridine-5'-monophosphate
  • [(2r,3s,5r)-3-hydroxy-5-[5-(methoxymethyl)-2,4-dioxo-1-pyrimidinyl]-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[5-(methoxymethyl)-2,4-dioxo-pyrimidin-1-yl]oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[5-(methoxymethyl)-2,4-dioxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-3-hydroxy-5-[5-(methoxymethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,5r)-5-[2,4-diketo-5-(methoxymethyl)pyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • mmudr-mp
CAS Number(s)
  • 53212-98-9
InChIKey DCWNIFTUDYKKFN-DJLDLDEBSA-N
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