2-{3-Acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodobenzamido}-2-deoxyhexitol

Base Information

• Chemical Name: 2-{3-Acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodobenzamido}-2-deoxyhexitol
• CAS No.: 31112-66-0
• Molecular Formula: C18H24 I3 N3 O8
• Molecular Weight: 791.11
• DSSTox Substance ID: DTXSID70865582
• Mol file: 31112-66-0.mol

Synonyms:DTXSID70865582;2-{3-Acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodobenzamido}-2-deoxyhexitol

Chemical Property of 2-{3-Acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodobenzamido}-2-deoxyhexitol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 996.6°C at 760 mmHg
• Flash Point: 556.6°C
• Density: 2.245g/cm³
• XLogP3: -2.1
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 790.8698
• Heavy Atom Count: 32
• Complexity: 675

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)NC1=C(C(=C(C(=C1I)C(=O)NC(CO)C(C(C(CO)O)O)O)I)N(C)C(=O)C)I