5-Hydroxymethyldeoxycytidylic Acid
[CAS 13009-95-5]

Identification

• Name: 5-Hydroxymethyldeoxycytidylic Acid
• Synonyms: [(2R,3S,5R)-5-[4-Amino-5-(Hydroxymethyl)-2-Oxo-Pyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate; [(2R,3S,5R)-5-[4-Amino-5-(Hydroxymethyl)-2-Oxo-1-Pyrimidinyl]-3-Hydroxy-2-Tetrahydrofuranyl]Methyl Dihydrogen Phosphate; [(2R,3S,5R)-5-(4-Amino-2-Keto-5-Methylol-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₁₀H₁₆N₃O₈P
• Molecular Weight: 337.23
• CAS Registry Number: 13009-95-5
• SMILES: [C@@H]1(O[C@H](C[C@@H]1O)N2C(N=C(C(=C2)CO)N)=O)CO[P](O)(=O)O
• InChI: 1S/C10H16N3O8P/c11-9-5(3-14)2-13(10(16)12-9)8-1-6(15)7(21-8)4-20-22(17,18)19/h2,6-8,14-15H,1,3-4H2,(H2,11,12,16)(H2,17,18,19)/t6-,7+,8+/m0/s1
• InChIKey: BTIWPBKNTZFNRI-XLPZGREQSA-N

Properties

• Density: 2.031g/cm³ (Cal.)
• Boiling point: 702.599°C at 760 mmHg (Cal.)
• Flash point: 378.718°C (Cal.)