Thymidine 5'-(4-Methylbenzenesulfonate)
[CAS# 7253-19-2]

Identification

• Name: Thymidine 5'-(4-Methylbenzenesulfonate)
• Synonyms: [3-Hydroxy-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl 4-Methylbenzenesulfonate; 4-Methylbenzenesulfonic Acid [3-Hydroxy-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-2-Tetrahydrofuranyl]Methyl Ester; 4-Methylbenzenesulfonic Acid [5-(2,4-Diketo-5-Methyl-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Ester
• Molecular Formula: C₁₇H₂₀N₂O₇S
• Molecular Weight: 396.41
• CAS Registry Number: 7253-19-2
• SMILES: C3=C([S](OCC2OC(N1C(NC(=O)C(=C1)C)=O)CC2O)(=O)=O)C=CC(=C3)C
• InChI: 1S/C17H20N2O7S/c1-10-3-5-12(6-4-10)27(23,24)25-9-14-13(20)7-15(26-14)19-8-11(2)16(21)18-17(19)22/h3-6,8,13-15,20H,7,9H2,1-2H3,(H,18,21,22)
• InChIKey: RSEWNGNFIIXLHN-UHFFFAOYSA-N

Properties

• Density: 1.425g/cm³ (Cal.)