[2-Acetyl-1-(2,4-dihydroxyphenyl)-3-oxobutyl]propanedioic acid

Base Information

• Chemical Name: [2-Acetyl-1-(2,4-dihydroxyphenyl)-3-oxobutyl]propanedioic acid
• CAS No.: 79339-09-6
• Molecular Formula: C15H16O8
• DSSTox Substance ID: DTXSID80508418

Synonyms:79339-09-6;DTXSID80508418;[2-Acetyl-1-(2,4-dihydroxyphenyl)-3-oxobutyl]propanedioic acid

Chemical Property of [2-Acetyl-1-(2,4-dihydroxyphenyl)-3-oxobutyl]propanedioic acid

Chemical Property:

• XLogP3: 0.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 324.08451746
• Heavy Atom Count: 23
• Complexity: 472

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C(C(C1=C(C=C(C=C1)O)O)C(C(=O)O)C(=O)O)C(=O)C

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