2,8-Diamino-1,9-Dihydro-9-((2-Hydroxy-1-(Hydroxymethyl )Ethoxy)Methyl)-6H-Purin-6-One
[CAS# 98695-80-8]

Identification

• Name: 2,8-Diamino-1,9-Dihydro-9-((2-Hydroxy-1-(Hydroxymethyl )Ethoxy)Methyl)-6H-Purin-6-One
• Synonyms: 2,8-Diamino-9-[[2-Hydroxy-1-(Hydroxymethyl)Ethoxy]Methyl]-3H-Purin-6-One; 2,8-Diamino-9-[(2-Hydroxy-1-Methylol-Ethoxy)Methyl]-3H-Purin-6-One; Pd 116124
• Molecular Formula: C₉H₁₄N₆O₄
• Molecular Weight: 270.25
• CAS Registry Number: 98695-80-8
• SMILES: C([N]2C1=C(C(N=C(N1)N)=O)N=C2N)OC(CO)CO
• InChI: 1S/C9H14N6O4/c10-8-13-6-5(7(18)14-8)12-9(11)15(6)3-19-4(1-16)2-17/h4,16-17H,1-3H2,(H2,11,12)(H3,10,13,14,18)
• InChIKey: SYAUXCCCMBAREC-UHFFFAOYSA-N

Properties

• Density: 1.967g/cm³ (Cal.)
• Boiling point: 707.984°C at 760 mmHg (Cal.)
• Flash point: 381.975°C (Cal.)