3a,4,7,7a-Tetrahydro-2-benzofuran-1,3-dione;benzene-1,3-dicarboxylic acid;furan-2,5-dione;propane-1,2-diol

Base Information

• Chemical Name: 3a,4,7,7a-Tetrahydro-2-benzofuran-1,3-dione;benzene-1,3-dicarboxylic acid;furan-2,5-dione;propane-1,2-diol
• CAS No.: 54626-77-6
• Molecular Formula: C23H24O12
• Molecular Weight: 492.42946
• Mol file: 54626-77-6.mol

Synonyms:54626-77-6;(C8-H8-O3.C8-H6-O4.C4-H2-O3.C3-H8-O2)x-

Chemical Property of 3a,4,7,7a-Tetrahydro-2-benzofuran-1,3-dione;benzene-1,3-dicarboxylic acid;furan-2,5-dione;propane-1,2-diol

Chemical Property:

• PSA: 201.80000
• LogP: 0.72070
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 3
• Exact Mass: 492.12677620
• Heavy Atom Count: 35
• Complexity: 547

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CO)O.C1C=CCC2C1C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O