N(4)-Hydroxy-5-Fluorodeoxycytidine Monophosphate
[CAS 114333-22-1]

Identification

• Name: N(4)-Hydroxy-5-Fluorodeoxycytidine Monophosphate
• Synonyms: [(2R,3S,5R)-5-[5-Fluoro-4-(Hydroxyamino)-2-Oxo-Pyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate; [(2R,3S,5R)-5-[5-Fluoro-4-(Hydroxyamino)-2-Oxo-1-Pyrimidinyl]-3-Hydroxy-2-Tetrahydrofuranyl]Methyl Dihydrogen Phosphate; [(2R,3S,5R)-5-[5-Fluoro-4-(Hydroxyamino)-2-Keto-Pyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₉H₁₃FN₃O₈P
• Molecular Weight: 341.19
• CAS Registry Number: 114333-22-1
• SMILES: [C@@H]1(CO[P](=O)(O)O)[C@@H](O)C[C@@H](O1)N2C(=O)N=C(NO)C(=C2)F
• InChI: 1S/C9H13FN3O8P/c10-4-2-13(9(15)11-8(4)12-16)7-1-5(14)6(21-7)3-20-22(17,18)19/h2,5-7,14,16H,1,3H2,(H,11,12,15)(H2,17,18,19)/t5-,6+,7+/m0/s1
• InChIKey: NLJQYFRLORVALI-RRKCRQDMSA-N

Properties

• Density: 2.122g/cm³ (Cal.)
• Boiling point: 629.165°C at 760 mmHg (Cal.)
• Flash point: 334.307°C (Cal.)