Mono(4-Aminophenyl)-3'-Thymidylic Acid Ester
[CAS# 24960-61-0]

Identification

• Name: Mono(4-Aminophenyl)-3'-Thymidylic Acid Ester
• Synonyms: (4-Aminophenyl) [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-3-Yl] Hydrogen Phosphate; (4-Aminophenyl) [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-3-Tetrahydrofuranyl] Hydrogen Phosphate; (4-Aminophenyl) [(2R,3S,5R)-5-(2,4-Diketo-5-Methyl-Pyrimidin-1-Yl)-2-Methylol-Tetrahydrofuran-3-Yl] Hydrogen Phosphate
• Molecular Formula: C₁₆H₂₀N₃O₈P
• Molecular Weight: 413.32
• CAS Registry Number: 24960-61-0
• SMILES: [C@H]2(O[C@@H]([C@@H](O[P](OC1=CC=C(N)C=C1)(=O)O)C2)CO)N3C(=O)NC(=O)C(=C3)C
• InChI: 1S/C16H20N3O8P/c1-9-7-19(16(22)18-15(9)21)14-6-12(13(8-20)25-14)27-28(23,24)26-11-4-2-10(17)3-5-11/h2-5,7,12-14,20H,6,8,17H2,1H3,(H,23,24)(H,18,21,22)/t12-,13+,14+/m0/s1
• InChIKey: HXGZBJUOISOSHJ-BFHYXJOUSA-N

Properties

• Density: 1.582g/cm³ (Cal.)