2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran

C202H126O4 — CID 158780086

About 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran

2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran (PubChem CID 158780086) has the molecular formula C202H126O4 and a molecular weight of 2617.23 g/mol. Its IUPAC name is 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran.

Molecular Properties

• Compound Name: 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran
• PubChem CID: 158780086
• Molecular Formula: C202H126O4
• Molecular Weight: 2617.23 g/mol
• Exact Mass: 2614.97
• IUPAC Name: 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran
• SMILES: c1ccc(-c2ccc3c(oc4ccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)cc43)c2-c2ccccc2)cc1.c1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5ccc6oc7cccc(-c8ccccc8)c7c6c5)c5ccccc45)ccc3c2)cc1.c1ccc(-c2cccc(-c3ccc4oc5ccc(-c6c7ccccc7c(-c7ccccc7-c7ccc8ccccc8c7)c7ccccc67)cc5c4c3)c2)cc1.c1ccc(-c2ccccc2-c2ccc3c(c2)oc2ccc(-c4c5ccccc5c(-c5cc6ccccc6c6ccccc56)c5ccccc45)cc23)cc1
• InChI: InChI=1S/C54H34O.C52H32O.2C48H30O/c1-2-13-35(14-3-1)38-17-12-18-39(31-38)40-27-29-51-49(33-40)50-34-42(28-30-52(50)55-51)53-45-21-8-10-23-47(45)54(48-24-11-9-22-46(48)53)44-20-7-6-19-43(44)41-26-25-36-15-4-5-16-37(36)32-41;1-2-14-33(15-3-1)37-17-6-7-18-38(37)35-26-28-42-47-31-36(27-29-49(47)53-50(42)32-35)51-43-22-10-12-24-45(43)52(46-25-13-11-23-44(46)51)48-30-34-16-4-5-19-39(34)40-20-8-9-21-41(40)48;1-3-12-31(13-4-1)33-22-23-35-29-36(25-24-34(35)28-33)46-39-16-7-9-18-41(39)47(42-19-10-8-17-40(42)46)37-26-27-44-43(30-37)48-38(20-11-21-45(48)49-44)32-14-5-2-6-15-32;1-3-14-32(15-4-1)36-27-28-42-43-30-34(26-29-44(43)49-48(42)46(36)33-17-5-2-6-18-33)45-38-21-9-11-23-40(38)47(41-24-12-10-22-39(41)45)37-25-13-19-31-16-7-8-20-35(31)37/h1-34H;1-32H;2*1-30H
• InChIKey: IQYQOOHMACROAN-UHFFFAOYSA-N
• XLogP: 57.67
• TPSA: 52.56 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 17
• Heavy Atoms: 206
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2617.23
LogP ≤ 5	57.67
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

The IUPAC name of 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran (CID 158780086) is 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran.

What is the SMILES notation for 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

The canonical SMILES for 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran is c1ccc(-c2ccc3c(oc4ccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)cc43)c2-c2ccccc2)cc1.c1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5ccc6oc7cccc(-c8ccccc8)c7c6c5)c5ccccc45)ccc3c2)cc1.c1ccc(-c2cccc(-c3ccc4oc5ccc(-c6c7ccccc7c(-c7ccccc7-c7ccc8ccccc8c7)c7ccccc67)cc5c4c3)c2)cc1.c1ccc(-c2ccccc2-c2ccc3c(c2)oc2ccc(-c4c5ccccc5c(-c5cc6ccccc6c6ccccc56)c5ccccc45)cc23)cc1.

What is the InChIKey of 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

The InChIKey is IQYQOOHMACROAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34O.C52H32O.2C48H30O/c1-2-13-35(14-3-1)38-17-12-18-39(31-38)40-27-29-51-49(33-40)50-34-42(28-30-52(50)55-51)53-45-21-8-10-23-47(45)54(48-24-11-9-22-46(48)53)44-20-7-6-19-43(44)41-26-25-36-15-4-5-16-37(36)32-41;1-2-14-33(15-3-1)37-17-6-7-18-38(37)35-26-28-42-47-31-36(27-29-49(47)53-50(42)32-35)51-43-22-10-12-24-45(43)52(46-25-13-11-23-44(46)51)48-30-34-16-4-5-19-39(34)40-20-8-9-21-41(40)48;1-3-12-31(13-4-1)33-22-23-35-29-36(25-24-34(35)28-33)46-39-16-7-9-18-41(39)47(42-19-10-8-17-40(42)46)37-26-27-44-43(30-37)48-38(20-11-21-45(48)49-44)32-14-5-2-6-15-32;1-3-14-32(15-4-1)36-27-28-42-43-30-34(26-29-44(43)49-48(42)46(36)33-17-5-2-6-18-33)45-38-21-9-11-23-40(38)47(41-24-12-10-22-39(41)45)37-25-13-19-31-16-7-8-20-35(31)37/h1-34H;1-32H;2*1-30H.

What are the key properties of 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran?

2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran has a molecular weight of 2617.23 g/mol, XLogP of 57.67, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(10-naphthalen-1-ylanthracen-9-yl)-6,7-diphenyldibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]-8-(3-phenylphenyl)dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)-7-(2-phenylphenyl)dibenzofuran;1-phenyl-8-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran is sourced from PubChem (CID 158780086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).