3'-O-Acetyladenosine
[CAS# 6554-21-8]

Identification

• Name: 3'-O-Acetyladenosine
• Synonyms: [2-Oxo-2-[4-(Phenylmethyl)-1-Piperidyl]Ethyl] 2-Methylbenzoate; 2-Methylbenzoic Acid [2-Oxo-2-[4-(Phenylmethyl)-1-Piperidinyl]Ethyl] Ester; 2-Methylbenzoic Acid [2-[4-(Benzyl)-1-Piperidyl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₂H₂₅NO₃
• Molecular Weight: 351.44
• CAS Registry Number: 6554-21-8
• SMILES: C1=CC=CC(=C1C)C(=O)OCC(=O)N2CCC(CC2)CC3=CC=CC=C3
• InChI: 1S/C22H25NO3/c1-17-7-5-6-10-20(17)22(25)26-16-21(24)23-13-11-19(12-14-23)15-18-8-3-2-4-9-18/h2-10,19H,11-16H2,1H3
• InChIKey: YOFURCDZIRANPY-UHFFFAOYSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 533.755°C at 760 mmHg (Cal.)
• Flash point: 276.606°C (Cal.)