3,6-Dichlorotrimellitic anhydride

Base Information

• Chemical Name: 3,6-Dichlorotrimellitic anhydride
• CAS No.: 81742-10-1
• Molecular Formula: C9H2Cl2O5
• Molecular Weight: 261.018
• European Community (EC) Number: 862-993-4
• DSSTox Substance ID: DTXSID50579115
• Nikkaji Number: J2.936.806F
• Wikidata: Q82469527
• Mol file: 81742-10-1.mol

Synonyms:3,6-dichlorotrimellitic anhydride;81742-10-1;3, 6-dichloro-4-carboxyphthalic anhydride;3,6-Dichloro trimellitic anhydride;4,7-dichloro-1,3-dioxo-1,3-dihydroisobenzofuran-5-carboxylic acid;4,7-DICHLORO-1,3-DIOXO-2-BENZOFURAN-5-CARBOXYLIC ACID;5-Isobenzofurancarboxylic acid, 4,7-dichloro-1,3-dihydro-1,3-dioxo-;SCHEMBL2884593;3,6-dichlorotrimelliticanhydride;DTXSID50579115;HY-D0829;MFCD28962732;AKOS027339782;CS-5024;DS-12391;PD100568;F12200;A897883;4,7-Dichloro-1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylic acid

Chemical Property of 3,6-Dichlorotrimellitic anhydride

Chemical Property:

• Boiling Point: 475.9±45.0 °C(Predicted)
• PKA: 1.19±0.20(Predicted)
• PSA: 80.67000
• Density: 1.877±0.06 g/cm3(Predicted)
• LogP: 2.00220
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 259.9279285
• Heavy Atom Count: 16
• Complexity: 369

Purity/Quality:

98%Min ^*data from raw suppliers

3,6-DichlorotrimelliticAnhydride 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=C2C(=C1Cl)C(=O)OC2=O)Cl)C(=O)O