Diammonium 9-[2-deoxy-3,5-bis-O-(hydroxyphosphinato)pentofuranosyl]-N-methyl-9H-purin-6-amine
[CAS# 101204-49-3]

Identification

• Name: Diammonium 9-[2-deoxy-3,5-bis-O-(hydroxyphosphinato)pentofuranosyl]-N-methyl-9H-purin-6-amine
• Synonyms: 9H-Purin-6-amine, 9-[2-deoxy-3,5-bis-O-(hydroxyphosphinato)pentofuranosyl]-N-methyl-, ammonium salt (1:2); Diammonium 9-[2-deoxy-3,5-bis-O-(hydroxyphosphinato)pentofuranosyl]-N-methyl-9H-purin-6-amine; MRSÂ 2179 AMMONIUM SALT HYDRATE
• Molecular Formula: C₁₁H₂₃N₇O₉P₂
• Molecular Weight: 459.29
• CAS Registry Number: 101204-49-3
• SMILES: CNc1c2c(ncn1)n(cn2)C3CC(C(O3)COP(=O)(O)[O-])OP(=O)(O)[O-].[NH4+].[NH4+]
• InChI: 1S/C11H17N5O9P2.2H3N/c1-12-10-9-11(14-4-13-10)16(5-15-9)8-2-6(25-27(20,21)22)7(24-8)3-23-26(17,18)19;;/h4-8H,2-3H2,1H3,(H,12,13,14)(H2,17,18,19)(H2,20,21,22);2*1H3
• InChIKey: GAQWEBYIOMWWHZ-UHFFFAOYSA-N

Properties

• Refractive index: (Cal.)