4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran

C92H56O2 — CID 148826059

About 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran

4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran (PubChem CID 148826059) has the molecular formula C92H56O2 and a molecular weight of 1193.46 g/mol. Its IUPAC name is 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran.

Molecular Properties

• Compound Name: 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran
• PubChem CID: 148826059
• Molecular Formula: C92H56O2
• Molecular Weight: 1193.46 g/mol
• Exact Mass: 1192.43
• IUPAC Name: 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran
• SMILES: c1ccc(-c2cc(-c3ccc(-c4ccc(-c5c6ccccc6c(-c6ccccc6-c6cccc7ccccc67)c6ccccc56)cc4)c4c3oc3ccccc34)ccc2-c2c3ccccc3c(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccccc23)cc1
• InChI: InChI=1S/C92H56O2/c1-2-22-58(23-3-1)82-56-63(52-53-79(82)89-77-35-14-10-31-73(77)87(74-32-11-15-36-78(74)89)61-48-44-59(45-49-61)65-39-21-43-85-90(65)80-37-16-18-41-83(80)93-85)67-55-54-66(91-81-38-17-19-42-84(81)94-92(67)91)60-46-50-62(51-47-60)86-71-29-8-12-33-75(71)88(76-34-13-9-30-72(76)86)70-28-7-6-27-69(70)68-40-20-25-57-24-4-5-26-64(57)68/h1-56H
• InChIKey: OSTCKYJNEUWNAS-UHFFFAOYSA-N
• XLogP: 26.25
• TPSA: 26.28 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 9
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1193.46
LogP ≤ 5	26.25
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran?

The IUPAC name of 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran (CID 148826059) is 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran.

What is the SMILES notation for 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran?

The canonical SMILES for 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran is c1ccc(-c2cc(-c3ccc(-c4ccc(-c5c6ccccc6c(-c6ccccc6-c6cccc7ccccc67)c6ccccc56)cc4)c4c3oc3ccccc34)ccc2-c2c3ccccc3c(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccccc23)cc1.

What is the InChIKey of 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran?

The InChIKey is OSTCKYJNEUWNAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C92H56O2/c1-2-22-58(23-3-1)82-56-63(52-53-79(82)89-77-35-14-10-31-73(77)87(74-32-11-15-36-78(74)89)61-48-44-59(45-49-61)65-39-21-43-85-90(65)80-37-16-18-41-83(80)93-85)67-55-54-66(91-81-38-17-19-42-84(81)94-92(67)91)60-46-50-62(51-47-60)86-71-29-8-12-33-75(71)88(76-34-13-9-30-72(76)86)70-28-7-6-27-69(70)68-40-20-25-57-24-4-5-26-64(57)68/h1-56H.

What are the key properties of 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran?

4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran has a molecular weight of 1193.46 g/mol, XLogP of 26.25, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-[10-(4-dibenzofuran-1-ylphenyl)anthracen-9-yl]-3-phenylphenyl]-1-[4-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran is sourced from PubChem (CID 148826059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).