4-[(3-Oxo-1-cyclohexen-1-yl)amino]benzoic acid

Base Information

• Chemical Name: 4-[(3-Oxo-1-cyclohexen-1-yl)amino]benzoic acid
• CAS No.: 51924-58-4
• Molecular Formula: C₁₃H₁₃NO₃
• Molecular Weight: 231.251
• DSSTox Substance ID: DTXSID801246849

Synonyms:4-[(3-Oxo-1-cyclohexen-1-yl)amino]benzoic acid;51924-58-4;DTXSID801246849

Chemical Property of 4-[(3-Oxo-1-cyclohexen-1-yl)amino]benzoic acid

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 231.08954328
• Heavy Atom Count: 17
• Complexity: 341

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1CC(=CC(=O)C1)NC2=CC=C(C=C2)C(=O)O

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