5-Biphenyl-4-yl-3-methyl-5-oxo-pentanoic acid

Base Information

• Chemical Name: 5-Biphenyl-4-yl-3-methyl-5-oxo-pentanoic acid
• CAS No.: 7320-97-0
• Molecular Formula: C₁₈H₁₈O₃
• Molecular Weight: 282.339
• ChEMBL ID: CHEMBL3246893
• DSSTox Substance ID: DTXSID90875027
• Nikkaji Number: J1.583.045J

Synonyms:CHEMBL3246893;7320-97-0;SCHEMBL11871072;DTXSID90875027;BDBM50009726;AKOS012231782;5-Biphenyl-4-yl-3-methyl-5-oxo-pentanoic acid;PENTANOIC ACID, 5-[(1,1'-BIPHENYL)-4-YL]-3-METHY

Chemical Property of 5-Biphenyl-4-yl-3-methyl-5-oxo-pentanoic acid

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 282.125594432
• Heavy Atom Count: 21
• Complexity: 350

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)CC(=O)O

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