3'-O-Benzoyl-2'-deoxyinosine
[CAS# 93778-58-6]

Identification

• Name: 3'-O-Benzoyl-2'-deoxyinosine
• Synonyms: 2'-deoxyinosine 3'-benzoate
• Molecular Formula: C₁₇H₁₆N₄O₅
• Molecular Weight: 356.33
• CAS Registry Number: 93778-58-6
• EINECS: 298-196-8
• SMILES: Oc4ncnc3c4ncn3[C@H]2C[C@H](OC(=O)c1ccccc1)[C@@H](CO)O2
• InChI: 1S/C17H16N4O5/c22-7-12-11(26-17(24)10-4-2-1-3-5-10)6-13(25-12)21-9-20-14-15(21)18-8-19-16(14)23/h1-5,8-9,11-13,22H,6-7H2,(H,18,19,23)/t11-,12+,13+/m0/s1
• InChIKey: RZQPZGXOKJLURQ-YNEHKIRRSA-N

Properties

• Density: 1.606g/cm³ (Cal.)
• Boiling point: 631.827°C at 760 mmHg (Cal.)
• Flash point: 335.917°C (Cal.)