5-Cyano-2,4,6-triiodoisophthalic acid

Base Information

• Chemical Name: 5-Cyano-2,4,6-triiodoisophthalic acid
• CAS No.: 73511-89-4
• Molecular Formula: C9H2 I3 N O4
• Molecular Weight: 568.82989
• European Community (EC) Number: 277-514-9
• DSSTox Substance ID: DTXSID20994275
• Nikkaji Number: J295.232G
• Wikidata: Q82985156
• Mol file: 73511-89-4.mol

Synonyms:5-Cyano-2,4,6-triiodoisophthalic acid;73511-89-4;EINECS 277-514-9;5-cyano-2,4,6-triiodobenzene-1,3-dicarboxylic acid;C9H2I3NO4;SCHEMBL9787531;DTXSID20994275;DAMMTPUDAGMEIL-UHFFFAOYSA-N;C9-H2-I3-N-O4;5-Cyano-2,4,6-triiodo-1,3-benzenedicarboxylic acid

Chemical Property of 5-Cyano-2,4,6-triiodoisophthalic acid

Chemical Property:

• Vapor Pressure: 4.67E-13mmHg at 25°C
• Boiling Point: 552.9°C at 760 mmHg
• Flash Point: 288.2°C
• Density: 3.15g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 568.7118
• Heavy Atom Count: 17
• Complexity: 365

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(#N)C1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I