N-Methyl-2'-O-Methylcytidine

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Properties Simple | Detailed

Formula C11H17N3O5
IUPAC Name 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-4-(methylamino)pyrimidin-2-one
Molecular Mass 271.270 g·mol−1
Heat of Formation -743.6 ± 16.7 kJ·mol−1
Dipole Moment 7.66 ± 1.08 D
Volume 306.72 Å 3
Surface Area 278.32 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,3r,4r,5r)-4-hydroxy-3-methoxy-5-methylol-tetrahydrofuran-2-yl]-4-methylamino-pyrimidin-2-one
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-2-tetrahydrofuranyl]-4-methylamino-2-pyrimidinone
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-oxolan-2-yl]-4-methylamino-pyrimidin-2-one
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-4-methylamino-pyrimidin-2-one
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-4-methylaminopyrimidin-2-one
  • n(4), o(2')-dimethylcytidine
CAS Number(s)
  • 13048-95-8
InChIKey BNXGRQLXOMSOMV-PEBGCTIMSA-N
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