2-benzofuran-1,3-dione;(E)-but-2-enedioic acid;dodecane-1,12-diol

Base Information

• Chemical Name: 2-benzofuran-1,3-dione;(E)-but-2-enedioic acid;dodecane-1,12-diol
• CAS No.: 68784-89-4
• Molecular Formula: C24H34O9
• Molecular Weight: 466.5214
• Mol file: 68784-89-4.mol

Synonyms:68784-89-4;(C12-H20-O2.C8-H4-O3.C4-H4-O4)x-

Chemical Property of 2-benzofuran-1,3-dione;(E)-but-2-enedioic acid;dodecane-1,12-diol

Chemical Property:

• Boiling Point: 313.3°Cat760mmHg
• Flash Point: 151.1°C
• PSA: 158.43000
• Density: g/cm³
• LogP: 3.58100
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 13
• Exact Mass: 466.22028266
• Heavy Atom Count: 33
• Complexity: 389

Purity/Quality:

99.0%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)OC2=O.C(CCCCCCO)CCCCCO.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C1=CC=C2C(=C1)C(=O)OC2=O.C(CCCCCCO)CCCCCO.C(=C/C(=O)O)\C(=O)O