3-[3-Acetyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid

Base Information

• Chemical Name: 3-[3-Acetyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
• CAS No.: 5139-82-2
• Molecular Formula: C16H17NO7
• Molecular Weight: 335.3087
• DSSTox Substance ID: DTXSID20389728

Synonyms:5139-82-2;DTXSID20389728;AKOS000568576;AKOS025152800;SR-01000489925;SR-01000489925-1;3-[3-acetyl-4-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-5-oxo-2H-pyrrol-1-yl]propanoic acid;3-[3-Acetyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid

Chemical Property of 3-[3-Acetyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid

Chemical Property:

• Vapor Pressure: 1.43E-18mmHg at 25°C
• Boiling Point: 664.6°Cat760mmHg
• Flash Point: 355.8°C
• Density: 1.463g/cm³
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 335.10050188
• Heavy Atom Count: 24
• Complexity: 571

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=C(C(=O)N(C1C2=CC(=C(C=C2)O)OC)CCC(=O)O)O

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