2-(4-Biphenylyl)-5-phenyl-1,3,4-oxadiazole

• CAS: 852-38-0
• Catalog Number: ACM852380
• Category: Organic & Printed Electronics
• Molecular Weight: 298.34
• Molecular Formula: C20H14N2O
• Synonyms: 2-Phenyl-5-(4-biphenylyl)-1,3,4-oxadiazole,PBD
• IUPAC Name: 2-phenyl-5-(4-phenylphenyl)-1,3,4-oxadiazole
• Canonical SMILES: c1ccc(cc1)-c2ccc(cc2)-c3nnc(o3)-c4ccccc4
• InChI: 1S/C20H14N2O/c1-3-7-15(8-4-1)16-11-13-18(14-12-16)20-22-21-19(23-20)17-9-5-2-6-10-17/h1-14H,WMAXWOOEPJQXEB-UHFFFAOYSA-N
• InChI Key: WMAXWOOEPJQXEB-UHFFFAOYSA-N
• Melting Point: 167-169 °C (lit.)
• Application: Suitable as laser dye
• Storage: room temp
• Assay: 0.98
• Complexity: 355
• Covalently-Bonded Unit Count: 1
• EC Number: 212-712-0
• Exact Mass: 298.110613g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 0
• Heavy Atom Count: 23
• MDL Number: MFCD00003100
• Monoisotopic Mass: 298.110613g/mol
• NSC Number: 24858
• Packaging: 5 g in glass bottle
• Quality Level: 100
• Rotatable Bond Count: 3
• XLogP3: 4.7