5'-Methylthiotubercidin
[CAS# 61893-98-9]

Identification

• Name: 5'-Methylthiotubercidin
• Synonyms: 2-(4-Aminopyrrolo[2,3-D]Pyrimidin-7-Yl)-5-(Methylsulfanylmethyl)Tetrahydrofuran-3,4-Diol; 2-(4-Amino-7-Pyrrolo[2,3-D]Pyrimidinyl)-5-[(Methylthio)Methyl]Tetrahydrofuran-3,4-Diol; 2-(4-Aminopyrrolo[2,3-D]Pyrimidin-7-Yl)-5-[(Methylthio)Methyl]Tetrahydrofuran-3,4-Diol
• Molecular Formula: C₁₂H₁₆N₄O₃S
• Molecular Weight: 296.34
• CAS Registry Number: 61893-98-9
• SMILES: C2=CC1=C(N=CN=C1[N]2C3OC(C(O)C3O)CSC)N
• InChI: 1S/C12H16N4O3S/c1-20-4-7-8(17)9(18)12(19-7)16-3-2-6-10(13)14-5-15-11(6)16/h2-3,5,7-9,12,17-18H,4H2,1H3,(H2,13,14,15)
• InChIKey: WBPLMFVTQMIPLW-UHFFFAOYSA-N

Properties

• Density: 1.723g/cm³ (Cal.)
• Boiling point: 621.808°C at 760 mmHg (Cal.)
• Flash point: 329.858°C (Cal.)