1-phenyl-4-[4-(4-phenylphenyl)phenyl]benzene

• ChemBase ID: 296168
• Molecular Formular: C30H22
• Molecular Mass: 382.49568
• Monoisotopic Mass: 382.1721507
• SMILES: c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1ccccc1
• Canonical SMILES: c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1ccccc1
• InChI: InChI=1S/C30H22/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-30(22-20-29)28-17-13-26(14-18-28)24-9-5-2-6-10-24/h1-22H
• InChIKey: OMCUOJTVNIHQTI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-phenyl-4-[4-(4-phenylphenyl)phenyl]benzene
• IUPAC Traditional name: 1-phenyl-4-[4-(4-phenylphenyl)phenyl]benzene
• Synonyms: p-Quinquephenyl; 对五联苯

Database IDs

• CAS Number: 3073-05-0
• MDL Number: MFCD00059012
• PubChem SID: 180681699
• PubChem CID: 137813

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 8.562147
• LogD (pH = 7.4): 8.562147
• Log P: 8.562147
• Molar Refractivity: 126.6028 cm^3
• Polarizability: 55.000114 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• TSCA Listed: 否

Product Information

• Purity: 98%