(2R)-2-[(1R)-1-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-2-oxoethoxy]-3-oxopropyl trihydrogen diphosphate
[CAS# 87668-74-4]

Identification

• Name: (2R)-2-[(1R)-1-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-2-oxoethoxy]-3-oxopropyl trihydrogen diphosphate
• Synonyms: Cdp 2',3'-dialdehyde; Cytidine 5'-diphosphate 2',3'-dialdehyde
• Molecular Formula: C₉H₁₃N₃O₁₁P₂
• Molecular Weight: 401.16
• CAS Registry Number: 87668-74-4
• SMILES: O=C1/N=C(\C=C/N1[C@H](O[C@@H](C=O)COP(=O)(O)OP(=O)(O)O)C=O)N
• InChI: 1S/C9H13N3O11P2/c10-7-1-2-12(9(15)11-7)8(4-14)22-6(3-13)5-21-25(19,20)23-24(16,17)18/h1-4,6,8H,5H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/t6-,8+/m0/s1
• InChIKey: XKNZZWKZFGFISK-POYBYMJQSA-N

Properties

• Density: 2.007g/cm³ (Cal.)
• Boiling point: 665.037°C at 760 mmHg (Cal.)
• Flash point: 356.002°C (Cal.)