1,3,3a,4,7,7a-Hexahydro-1,3-dioxo-4,7-ethanoisobenzofuran-8-carboxylic acid

Base Information

• Chemical Name: 1,3,3a,4,7,7a-Hexahydro-1,3-dioxo-4,7-ethanoisobenzofuran-8-carboxylic acid
• CAS No.: 6000-06-2
• Molecular Formula: C11H10 O5
• Molecular Weight: 222.1941
• European Community (EC) Number: 227-839-7
• DSSTox Substance ID: DTXSID60975427
• Nikkaji Number: J223.939F
• Mol file: 6000-06-2.mol

Synonyms:6000-06-2;1,3,3a,4,7,7a-Hexahydro-1,3-dioxo-4,7-ethanoisobenzofuran-8-carboxylic acid;EINECS 227-839-7;SCHEMBL11313926;DTXSID60975427;1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-4,7-ethano-2-benzofuran-8-carboxylic acid

Chemical Property of 1,3,3a,4,7,7a-Hexahydro-1,3-dioxo-4,7-ethanoisobenzofuran-8-carboxylic acid

Chemical Property:

• Vapor Pressure: 1.03E-10mmHg at 25°C
• Boiling Point: 484.4°C at 760 mmHg
• Flash Point: 198.9°C
• Density: 1.513g/cm³
• XLogP3: 0
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 222.05282342
• Heavy Atom Count: 16
• Complexity: 424

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2C=CC(C1C(=O)O)C3C2C(=O)OC3=O