9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene

C112H72 — CID 160960650

About 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene

9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene (PubChem CID 160960650) has the molecular formula C112H72 and a molecular weight of 1417.81 g/mol. Its IUPAC name is 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene.

Molecular Properties

• Compound Name: 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene
• PubChem CID: 160960650
• Molecular Formula: C112H72
• Molecular Weight: 1417.81 g/mol
• Exact Mass: 1416.56
• IUPAC Name: 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene
• SMILES: c1ccc2c(-c3ccc(-c4ccc5ccc(-c6c7ccccc7c(-c7ccc(-c8cccc9ccccc89)cc7)c7ccccc67)cc5c4)cc3)cccc2c1.c1ccc2cc(-c3ccc(-c4ccc5ccc(-c6c7ccccc7c(-c7ccc(-c8cccc9ccccc89)cc7)c7ccccc67)cc5c4)cc3)ccc2c1
• InChI: InChI=1S/2C56H36/c1-3-15-47-39(11-1)13-9-21-49(47)41-27-23-37(24-28-41)44-33-25-38-26-34-45(36-46(38)35-44)56-53-19-7-5-17-51(53)55(52-18-6-8-20-54(52)56)43-31-29-42(30-32-43)50-22-10-14-40-12-2-4-16-48(40)50;1-2-12-44-34-45(31-24-37(44)10-1)38-20-22-39(23-21-38)46-32-25-40-26-33-47(36-48(40)35-46)56-53-17-7-5-15-51(53)55(52-16-6-8-18-54(52)56)43-29-27-42(28-30-43)50-19-9-13-41-11-3-4-14-49(41)50/h2*1-36H
• InChIKey: SWYUBNNXMYSTEO-UHFFFAOYSA-N
• XLogP: 31.58
• TPSA: 0.00 Ų
• Rotatable Bonds: 10
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1417.81
LogP ≤ 5	31.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene?

The IUPAC name of 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene (CID 160960650) is 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene.

What is the SMILES notation for 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene?

The canonical SMILES for 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene is c1ccc2c(-c3ccc(-c4ccc5ccc(-c6c7ccccc7c(-c7ccc(-c8cccc9ccccc89)cc7)c7ccccc67)cc5c4)cc3)cccc2c1.c1ccc2cc(-c3ccc(-c4ccc5ccc(-c6c7ccccc7c(-c7ccc(-c8cccc9ccccc89)cc7)c7ccccc67)cc5c4)cc3)ccc2c1.

What is the InChIKey of 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene?

The InChIKey is SWYUBNNXMYSTEO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H36/c1-3-15-47-39(11-1)13-9-21-49(47)41-27-23-37(24-28-41)44-33-25-38-26-34-45(36-46(38)35-44)56-53-19-7-5-17-51(53)55(52-18-6-8-20-54(52)56)43-31-29-42(30-32-43)50-22-10-14-40-12-2-4-16-48(40)50;1-2-12-44-34-45(31-24-37(44)10-1)38-20-22-39(23-21-38)46-32-25-40-26-33-47(36-48(40)35-46)56-53-17-7-5-15-51(53)55(52-16-6-8-18-54(52)56)43-29-27-42(28-30-43)50-19-9-13-41-11-3-4-14-49(41)50/h2*1-36H.

What are the key properties of 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene?

9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene has a molecular weight of 1417.81 g/mol, XLogP of 31.58, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene is sourced from PubChem (CID 160960650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).