7,7'-Trimethylenebis[1,3-Dimethyl-8-[Bis(2-Hydroxyethyl)Amino]-1H-Purine-2,6(3H,7H)-Dione]
[CAS# 63978-60-9]

Identification

• Name: 7,7'-Trimethylenebis[1,3-Dimethyl-8-[Bis(2-Hydroxyethyl)Amino]-1H-Purine-2,6(3H,7H)-Dione]
• Synonyms: 8-(Bis(2-Hydroxyethyl)Amino)-7-[3-[8-(Bis(2-Hydroxyethyl)Amino)-1,3-Dimethyl-2,6-Dioxo-Purin-7-Yl]Propyl]-1,3-Dimethyl-Purine-2,6-Dione; 8-(Bis(2-Hydroxyethyl)Amino)-7-[3-[8-(Bis(2-Hydroxyethyl)Amino)-1,3-Dimethyl-2,6-Dioxo-7-Purinyl]Propyl]-1,3-Dimethylpurine-2,6-Dione; 8-(Bis(2-Hydroxyethyl)Amino)-7-[3-[8-(Bis(2-Hydroxyethyl)Amino)-2,6-Diketo-1,3-Dimethyl-Purin-7-Yl]Propyl]-1,3-Dimethyl-Xanthine
• Molecular Formula: C₂₅H₃₈N₁₀O₈
• Molecular Weight: 606.64
• CAS Registry Number: 63978-60-9
• SMILES: C(CC[N]1C(=NC2=C1C(N(C(N2C)=O)C)=O)N(CCO)CCO)[N]3C(=NC4=C3C(N(C(N4C)=O)C)=O)N(CCO)CCO
• InChI: 1S/C25H38N10O8/c1-28-18-16(20(40)30(3)24(28)42)34(22(26-18)32(8-12-36)9-13-37)6-5-7-35-17-19(29(2)25(43)31(4)21(17)41)27-23(35)33(10-14-38)11-15-39/h36-39H,5-15H2,1-4H3
• InChIKey: SHMIBSKUQNMEDY-UHFFFAOYSA-N

Properties

• Density: 1.553g/cm³ (Cal.)
• Boiling point: 900.512°C at 760 mmHg (Cal.)
• Flash point: 498.412°C (Cal.)