1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran

C141H92O3 — CID 167596629

About 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran

1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran (PubChem CID 167596629) has the molecular formula C141H92O3 and a molecular weight of 1834.28 g/mol. Its IUPAC name is 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran.

Molecular Properties

• Compound Name: 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran
• PubChem CID: 167596629
• Molecular Formula: C141H92O3
• Molecular Weight: 1834.28 g/mol
• Exact Mass: 1832.70
• IUPAC Name: 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran
• SMILES: CC(C)c1cccc(-c2cccc3c2oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c1.c1ccc(-c2ccc(-c3ccccc3-c3cccc4c3oc3cccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)c34)cc2)cc1.c1ccc2cc(-c3cccc4c3oc3cccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)c34)ccc2c1
• InChI: InChI=1S/C54H34O.C46H28O.C41H30O/c1-2-15-35(16-3-1)36-31-33-38(34-32-36)39-19-6-7-21-41(39)47-27-13-29-49-53-48(28-14-30-50(53)55-54(47)49)52-45-24-10-8-22-43(45)51(44-23-9-11-25-46(44)52)42-26-12-18-37-17-4-5-20-40(37)42;1-2-14-31-28-32(27-26-29(31)12-1)34-21-10-24-41-45-40(23-11-25-42(45)47-46(34)41)44-38-19-7-5-17-36(38)43(37-18-6-8-20-39(37)44)35-22-9-15-30-13-3-4-16-33(30)35;1-26(2)28-15-10-16-29(25-28)30-21-11-23-36-40-35(22-12-24-37(40)42-41(30)36)39-33-19-8-6-17-31(33)38(27-13-4-3-5-14-27)32-18-7-9-20-34(32)39/h1-34H;1-28H;3-26H,1-2H3
• InChIKey: JDUFKXBICBXJIB-UHFFFAOYSA-N
• XLogP: 40.60
• TPSA: 39.42 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 12
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1834.28
LogP ≤ 5	40.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran?

The IUPAC name of 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran (CID 167596629) is 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran.

What is the SMILES notation for 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran?

The canonical SMILES for 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran is CC(C)c1cccc(-c2cccc3c2oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c1.c1ccc(-c2ccc(-c3ccccc3-c3cccc4c3oc3cccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)c34)cc2)cc1.c1ccc2cc(-c3cccc4c3oc3cccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)c34)ccc2c1.

What is the InChIKey of 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran?

The InChIKey is JDUFKXBICBXJIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34O.C46H28O.C41H30O/c1-2-15-35(16-3-1)36-31-33-38(34-32-36)39-19-6-7-21-41(39)47-27-13-29-49-53-48(28-14-30-50(53)55-54(47)49)52-45-24-10-8-22-43(45)51(44-23-9-11-25-46(44)52)42-26-12-18-37-17-4-5-20-40(37)42;1-2-14-31-28-32(27-26-29(31)12-1)34-21-10-24-41-45-40(23-11-25-42(45)47-46(34)41)44-38-19-7-5-17-36(38)43(37-18-6-8-20-39(37)44)35-22-9-15-30-13-3-4-16-33(30)35;1-26(2)28-15-10-16-29(25-28)30-21-11-23-36-40-35(22-12-24-37(40)42-41(30)36)39-33-19-8-6-17-31(33)38(27-13-4-3-5-14-27)32-18-7-9-20-34(32)39/h1-34H;1-28H;3-26H,1-2H3.

What are the key properties of 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran?

1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran has a molecular weight of 1834.28 g/mol, XLogP of 40.60, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(10-naphthalen-1-ylanthracen-9-yl)-6-[2-(4-phenylphenyl)phenyl]dibenzofuran;6-naphthalen-2-yl-1-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1-(10-phenylanthracen-9-yl)-6-(3-propan-2-ylphenyl)dibenzofuran is sourced from PubChem (CID 167596629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).