3,5-Bis(4-tert-butylphenyl)-4-phenyl-4h&

• Catalog Number: ACM203799762
• Product Name: 3,5-Bis(4-tert-butylphenyl)-4-phenyl-4h&
• CAS: 203799-76-2
• Category: Organic & Printed Electronics
• Synonyms: 3,5-BIS(4-TERT-BUTYLPHENYL)-4-PHENYL-4H&;3,5-Bis(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazole;3,5-Bis[4-(1,1-dimethylethyl)phenyl]-4-phenyl-4H-1,2,4-triazole
• IUPAC Name: 3,5-bis(4-tert-butylphenyl)-4-phenyl-1,2,4-triazole
• Molecular Weight: 409.6g/mol
• Molecular Formula: C28H31N3
• Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C
• InChI: InChI=1S/C28H31N3/c1-27(2,3)22-16-12-20(13-17-22)25-29-30-26(31(25)24-10-8-7-9-11-24)21-14-18-23(19-15-21)28(4,5)6/h7-19H,1-6H3
• InChI Key: ADENFOWRGOZGCW-UHFFFAOYSA-N
• Complexity: 510
• Covalently-Bonded Unit Count: 1
• Exact Mass: 409.251798g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 31
• Monoisotopic Mass: 409.251798g/mol
• Rotatable Bond Count: 5
• XLogP3: 7.8