2-(4-Methylphenyl)-5-(2-naphthyl)-1,3,4-oxadiazole

Base Information

• Chemical Name: 2-(4-Methylphenyl)-5-(2-naphthyl)-1,3,4-oxadiazole
• CAS No.: 52596-89-1
• Molecular Formula: C₁₉H₁₄N₂O
• Molecular Weight: 286.333
• NSC Number: 90810
• DSSTox Substance ID: DTXSID90293580
• Wikidata: Q82032408
• Pharos Ligand ID: V25SFDBVSAM5
• ChEMBL ID: CHEMBL1405325

Synonyms:NSC90810;52596-89-1;MLS002701939;NSC-90810;2-(4-methylphenyl)-5-(2-naphthyl)-1,3,4-oxadiazole;NCIStruc1_000645;NCIStruc2_000636;CHEMBL1405325;DTXSID90293580;NCI90810;CCG-36682;NCGC00013951;NCGC00013951-02;NCGC00097060-01;NCI60_042016;SMR001565522

Chemical Property of 2-(4-Methylphenyl)-5-(2-naphthyl)-1,3,4-oxadiazole

Chemical Property:

• Vapor Pressure: 6.78E-09mmHg at 25°C
• Boiling Point: 479.6°C at 760 mmHg
• Flash Point: 242.4°C
• Density: 1.194g/cm³
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 286.110613074
• Heavy Atom Count: 22
• Complexity: 366

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=NN=C(O2)C3=CC4=CC=CC=C4C=C3

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