5'-Methylthioformycin
[CAS# 91255-90-2]

Identification

• Name: 5'-Methylthioformycin
• Synonyms: (3R,4S,5S)-2-(7-Amino-2H-Pyrazolo[5,4-E]Pyrimidin-3-Yl)-5-(Methylsulfanylmethyl)Tetrahydrofuran-3,4-Diol; (3R,4S,5S)-2-(7-Amino-2H-Pyrazolo[5,4-E]Pyrimidin-3-Yl)-5-[(Methylthio)Methyl]Tetrahydrofuran-3,4-Diol
• Molecular Formula: C₁₁H₁₅N₅O₃S
• Molecular Weight: 297.33
• CAS Registry Number: 91255-90-2
• SMILES: [C@@H]1(O)[C@H](O)[C@H](OC1C3=C2N=CN=C(N)C2=N[NH]3)CSC
• InChI: 1S/C11H15N5O3S/c1-20-2-4-8(17)9(18)10(19-4)6-5-7(16-15-6)11(12)14-3-13-5/h3-4,8-10,17-18H,2H2,1H3,(H,15,16)(H2,12,13,14)/t4-,8-,9-,10?/m1/s1
• InChIKey: MKHSXTZLSSHHQZ-KYWMRQPGSA-N

Properties

• Density: 1.617g/cm³ (Cal.)
• Boiling point: 670.1°C at 760 mmHg (Cal.)
• Flash point: 359.1°C (Cal.)