5'-Deoxy-5'-Fluoro-5'-(Methylthio)Adenosine
[CAS# 119771-21-0]

Identification

• Name: 5'-Deoxy-5'-Fluoro-5'-(Methylthio)Adenosine
• Synonyms: (2R,3R,4S,5S)-2-(6-Aminopurin-9-Yl)-5-[(R)-Fluoro-Methylsulfanyl-Methyl]Tetrahydrofuran-3,4-Diol; (2R,3R,4S,5S)-2-(6-Amino-9-Purinyl)-5-[(R)-Fluoro-(Methylthio)Methyl]Tetrahydrofuran-3,4-Diol; (2R,3R,4S,5S)-2-(6-Aminopurin-9-Yl)-5-[(R)-Fluoro-(Methylthio)Methyl]Tetrahydrofuran-3,4-Diol
• Molecular Formula: C₁₁H₁₄FN₅O₃S
• Molecular Weight: 315.32
• CAS Registry Number: 119771-21-0
• SMILES: [C@@H]3(O[C@@H]([N]2C1=NC=NC(=C1N=C2)N)[C@H](O)[C@@H]3O)[C@@H](SC)F
• InChI: 1S/C11H14FN5O3S/c1-21-8(12)7-5(18)6(19)11(20-7)17-3-16-4-9(13)14-2-15-10(4)17/h2-3,5-8,11,18-19H,1H3,(H2,13,14,15)/t5-,6+,7-,8+,11+/m0/s1
• InChIKey: BTYPROBTLQKCNI-YUECIMINSA-N

Properties

• Density: 1.928g/cm³ (Cal.)
• Boiling point: 649.453°C at 760 mmHg (Cal.)
• Flash point: 346.577°C (Cal.)