8-[(2-Aminoethyl)Thio]-6,7-Dihydro-1,3-Dimethyl-6-Thioxo-1H-Purin-2(3H)-One
[CAS# 6559-88-2]

Identification

• Name: 8-[(2-Aminoethyl)Thio]-6,7-Dihydro-1,3-Dimethyl-6-Thioxo-1H-Purin-2(3H)-One
• Synonyms: 8-(2-Aminoethylsulfanyl)-1,3-Dimethyl-6-Thioxo-7H-Purin-2-One; 8-(2-Aminoethylthio)-1,3-Dimethyl-6-Thioxo-7H-Purin-2-One; Nciopen2_006510
• Molecular Formula: C₉H₁₃N₅OS₂
• Molecular Weight: 271.35
• CAS Registry Number: 6559-88-2
• SMILES: C(SC2=NC1=C(C(N(C(N1C)=O)C)=S)[NH]2)CN
• InChI: 1S/C9H13N5OS2/c1-13-6-5(7(16)14(2)9(13)15)11-8(12-6)17-4-3-10/h3-4,10H2,1-2H3,(H,11,12)
• InChIKey: OHAMGOXGOKLILR-UHFFFAOYSA-N

Properties

• Density: 1.554g/cm³ (Cal.)
• Boiling point: 510.001°C at 760 mmHg (Cal.)
• Flash point: 262.24°C (Cal.)