Sodium 5'-O-[(adamantan-1-ylamino)phosphinato]adenosine
[CAS# 133310-22-2]

Identification

• Name: Sodium 5'-O-[(adamantan-1-ylamino)phosphinato]adenosine
• Synonyms: A5'Paa; Adenosine 5'-phosphor(adamantyl)amidate; Adenosine, 5'-(hydrogen tricyclo(3.3.1.13,7)dec-1-ylphosphoramidate), monosodium salt
• Molecular Formula: C₂₀H₂₈N₆NaO₆P
• Molecular Weight: 502.44
• CAS Registry Number: 133310-22-2
• SMILES: [Na+].[O-]P(=O)(OC[C@H]3O[C@@H](n2cnc1c(ncnc12)N)[C@H](O)[C@@H]3O)NC46CC5CC(C4)CC(C5)C6
• InChI: 1S/C20H29N6O6P.Na/c21-17-14-18(23-8-22-17)26(9-24-14)19-16(28)15(27)13(32-19)7-31-33(29,30)25-20-4-10-1-11(5-20)3-12(2-10)6-20;/h8-13,15-16,19,27-28H,1-7H2,(H2,21,22,23)(H2,25,29,30);/q;+1/p-1/t10?,11?,12?,13-,15-,16-,19-,20?;/m1./s1
• InChIKey: HRDIMZMKGRTOBX-FSPCGKLCSA-M

Properties

• Boiling point: 777.9°C at 760 mmHg (Cal.)
• Flash point: 424.2°C (Cal.)
• Refractive index: (Cal.)