1-(2-Deoxy-beta-D-Ribofuranosyl)-5-(Methylmercapto)-2-Pyrimidinone
[CAS# 75670-13-2]

Identification

• Name: 1-(2-Deoxy-beta-D-Ribofuranosyl)-5-(Methylmercapto)-2-Pyrimidinone
• Synonyms: 1-[(2S,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-5-(Methylthio)-2-Pyrimidinone; 1-[(2S,4S,5R)-4-Hydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-5-(Methylthio)Pyrimidin-2-One; 1-[(2S,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-5-Methylsulfanyl-Pyrimidin-2-One
• Molecular Formula: C₁₀H₁₄N₂O₄S
• Molecular Weight: 258.29
• CAS Registry Number: 75670-13-2
• SMILES: [C@H]2(N1C(N=CC(=C1)SC)=O)O[C@@H]([C@@H](O)C2)CO
• InChI: 1S/C10H14N2O4S/c1-17-6-3-11-10(15)12(4-6)9-2-7(14)8(5-13)16-9/h3-4,7-9,13-14H,2,5H2,1H3/t7-,8+,9-/m0/s1
• InChIKey: KEIQSLRUOBLVRD-YIZRAAEISA-N

Properties

• Density: 1.574g/cm³ (Cal.)
• Boiling point: 485.224°C at 760 mmHg (Cal.)
• Flash point: 247.255°C (Cal.)