2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene

C161H110 — CID 161191738

About 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene

2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene (PubChem CID 161191738) has the molecular formula C161H110 and a molecular weight of 2044.65 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene.

Molecular Properties

• Compound Name: 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene
• PubChem CID: 161191738
• Molecular Formula: C161H110
• Molecular Weight: 2044.65 g/mol
• Exact Mass: 2042.86
• IUPAC Name: 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccccc5)c4c3)cc21.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cc5ccccc5c5ccccc45)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc23)cc1.c1ccc(-c2ccc(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccccc5)c4c3)cc2)cc1
• InChI: InChI=1S/C42H28.C41H30.C40H26.C38H26/c1-3-13-32(14-4-1)41-37-19-9-10-20-38(37)42(33-15-5-2-6-16-33)40-28-34(26-27-39(40)41)29-22-24-31(25-23-29)36-21-11-17-30-12-7-8-18-35(30)36;1-41(2)37-20-12-11-17-31(37)32-23-21-30(26-38(32)41)29-22-24-35-36(25-29)40(28-15-7-4-8-16-28)34-19-10-9-18-33(34)39(35)27-13-5-3-6-14-27;1-3-13-27(14-4-1)39-34-21-11-12-22-35(34)40(28-15-5-2-6-16-28)38-26-30(23-24-36(38)39)37-25-29-17-7-8-18-31(29)32-19-9-10-20-33(32)37;1-4-12-27(13-5-1)28-20-22-29(23-21-28)32-24-25-35-36(26-32)38(31-16-8-3-9-17-31)34-19-11-10-18-33(34)37(35)30-14-6-2-7-15-30/h1-28H;3-26H,1-2H3;1-26H;1-26H
• InChIKey: UTUUIJDZRDIHPI-UHFFFAOYSA-N
• XLogP: 45.08
• TPSA: 0.00 Ų
• Rotatable Bonds: 14
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2044.65
LogP ≤ 5	45.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

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-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene?

The IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene (CID 161191738) is 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene.

What is the SMILES notation for 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene?

The canonical SMILES for 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene is CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccccc5)c4c3)cc21.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cc5ccccc5c5ccccc45)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc23)cc1.c1ccc(-c2ccc(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccccc5)c4c3)cc2)cc1.

What is the InChIKey of 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene?

The InChIKey is UTUUIJDZRDIHPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28.C41H30.C40H26.C38H26/c1-3-13-32(14-4-1)41-37-19-9-10-20-38(37)42(33-15-5-2-6-16-33)40-28-34(26-27-39(40)41)29-22-24-31(25-23-29)36-21-11-17-30-12-7-8-18-35(30)36;1-41(2)37-20-12-11-17-31(37)32-23-21-30(26-38(32)41)29-22-24-35-36(25-29)40(28-15-7-4-8-16-28)34-19-10-9-18-33(34)39(35)27-13-5-3-6-14-27;1-3-13-27(14-4-1)39-34-21-11-12-22-35(34)40(28-15-5-2-6-16-28)38-26-30(23-24-36(38)39)37-25-29-17-7-8-18-31(29)32-19-9-10-20-33(32)37;1-4-12-27(13-5-1)28-20-22-29(23-21-28)32-24-25-35-36(26-32)38(31-16-8-3-9-17-31)34-19-11-10-18-33(34)37(35)30-14-6-2-7-15-30/h1-28H;3-26H,1-2H3;1-26H;1-26H.

What are the key properties of 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene?

2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene has a molecular weight of 2044.65 g/mol, XLogP of 45.08, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(9,9-dimethylfluoren-2-yl)-9,10-diphenylanthracene;9,10-diphenyl-2-(4-phenylphenyl)anthracene;2-(4-naphthalen-1-ylphenyl)-9,10-diphenylanthracene;2-phenanthren-9-yl-9,10-diphenylanthracene is sourced from PubChem (CID 161191738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).