Inosine, 2',3',5'-triacetate

Base Information

• Chemical Name: Inosine, 2',3',5'-triacetate
• CAS No.: 4754-05-6
• Molecular Formula: C16H18 N4 O7 S
• Molecular Weight: 410.40172
• European Community (EC) Number: 221-169-9
• NSC Number: 101763,98668,92028,83295,66385
• DSSTox Substance ID: DTXSID80952598
• Mol file: 4754-05-6.mol

Synonyms:3021-21-4;C16H18N4O7S;BI 293;Inosine, 6-thio-, 2',3',5'-triacetate;Oprea1_683392;DTXSID80952598;inosine, 2',3',5'-triacetate;NSC66385;NSC83295;NSC92028;NSC98668;NSC-66385;NSC-83295;NSC-92028;NSC-98668;NSC101763;AKOS003000639;NSC-101763;7687-42-5;9-(2,3,5-Tri-O-acetylpentofuranosyl)-9H-purine-6-thiol;4754-05-6

Chemical Property of Inosine, 2',3',5'-triacetate

Chemical Property:

• Boiling Point: 622.3°Cat760mmHg
• Flash Point: 330.1°C
• PSA: 170.53000
• Density: 1.61g/cm³
• LogP: 0.43890
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 8
• Exact Mass: 410.08962010
• Heavy Atom Count: 28
• Complexity: 703

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC=NC3=S)OC(=O)C)OC(=O)C