4-((2-(acetylamino)-9H-fluoren-9-ylidene)amino)benzoic acid

Base Information

• Chemical Name: 4-((2-(acetylamino)-9H-fluoren-9-ylidene)amino)benzoic acid
• CAS No.: 5454-41-1
• Molecular Formula: C22H16 N2 O3
• Molecular Weight: 356.37
• NSC Number: 23173
• DSSTox Substance ID: DTXSID50281822
• Pharos Ligand ID: HH9VLMRJTLD7
• ChEMBL ID: CHEMBL1410175
• Mol file: 5454-41-1.mol

Synonyms:NSC23173;5454-41-1;NSC-23173;NCIStruc1_001249;NCIStruc2_001157;CHEMBL1410175;DTXSID50281822;4-((2-(acetylamino)-9H-fluoren-9-ylidene)amino)benzoic acid;NCI23173;CCG-36879;NCGC00013293;NCGC00013293-02;NCGC00096410-01;NCI60_001879

Chemical Property of 4-((2-(acetylamino)-9H-fluoren-9-ylidene)amino)benzoic acid

Chemical Property:

• Vapor Pressure: 1.21E-17mmHg at 25°C
• Boiling Point: 647.4°Cat760mmHg
• Flash Point: 345.3°C
• PSA: 78.76000
• Density: 1.3g/cm³
• LogP: 4.56570
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 356.11609238
• Heavy Atom Count: 27
• Complexity: 609

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2=NC4=CC=C(C=C4)C(=O)O

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