2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene

C206H144 — CID 162005752

About 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene

2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene (PubChem CID 162005752) has the molecular formula C206H144 and a molecular weight of 2619.42 g/mol. Its IUPAC name is 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene.

Molecular Properties

• Compound Name: 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene
• PubChem CID: 162005752
• Molecular Formula: C206H144
• Molecular Weight: 2619.42 g/mol
• Exact Mass: 2617.13
• IUPAC Name: 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4cc(-c5ccc(-c6ccccc6)cc5)ccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccc(-c6ccccc6)cc5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)c5ccccc5c(-c5cccc6ccccc56)c4c3)cc21.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5cc6ccccc6c6ccccc56)ccc34)cc2)cc1
• InChI: InChI=1S/C54H40.2C51H36.C50H32/c1-53(2)47-22-11-9-17-38(47)40-27-24-35(31-49(40)53)34-25-29-45-46(30-34)52(42-21-13-15-33-14-5-6-16-37(33)42)44-20-8-7-19-43(44)51(45)36-26-28-41-39-18-10-12-23-48(39)54(3,4)50(41)32-36;1-51(2)47-22-11-10-18-40(47)41-29-28-38(32-48(41)51)49-43-19-8-9-20-44(43)50(42-21-12-16-36-15-6-7-17-39(36)42)46-31-37(27-30-45(46)49)35-25-23-34(24-26-35)33-13-4-3-5-14-33;1-51(2)47-19-11-10-16-41(47)42-28-26-39(32-48(42)51)38-27-29-45-46(31-38)50(40-25-22-34-14-6-7-15-37(34)30-40)44-18-9-8-17-43(44)49(45)36-23-20-35(21-24-36)33-12-4-3-5-13-33;1-2-12-33(13-3-1)35-22-25-36(26-23-35)49-44-20-10-11-21-45(44)50(40-27-24-34-14-4-5-15-37(34)30-40)48-32-39(28-29-46(48)49)47-31-38-16-6-7-17-41(38)42-18-8-9-19-43(42)47/h5-32H,1-4H3;2*3-32H,1-2H3;1-32H
• InChIKey: YSURITWLQQZGKL-UHFFFAOYSA-N
• XLogP: 57.12
• TPSA: 0.00 Ų
• Rotatable Bonds: 15
• Heavy Atoms: 206
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2619.42
LogP ≤ 5	57.12
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 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene?

The IUPAC name of 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene (CID 162005752) is 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene.

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

The canonical SMILES for 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene is CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4cc(-c5ccc(-c6ccccc6)cc5)ccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccc(-c6ccccc6)cc5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)c5ccccc5c(-c5cccc6ccccc56)c4c3)cc21.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5cc6ccccc6c6ccccc56)ccc34)cc2)cc1.

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

The InChIKey is YSURITWLQQZGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H40.2C51H36.C50H32/c1-53(2)47-22-11-9-17-38(47)40-27-24-35(31-49(40)53)34-25-29-45-46(30-34)52(42-21-13-15-33-14-5-6-16-37(33)42)44-20-8-7-19-43(44)51(45)36-26-28-41-39-18-10-12-23-48(39)54(3,4)50(41)32-36;1-51(2)47-22-11-10-18-40(47)41-29-28-38(32-48(41)51)49-43-19-8-9-20-44(43)50(42-21-12-16-36-15-6-7-17-39(36)42)46-31-37(27-30-45(46)49)35-25-23-34(24-26-35)33-13-4-3-5-14-33;1-51(2)47-19-11-10-16-41(47)42-28-26-39(32-48(42)51)38-27-29-45-46(31-38)50(40-25-22-34-14-6-7-15-37(34)30-40)44-18-9-8-17-43(44)49(45)36-23-20-35(21-24-36)33-12-4-3-5-13-33;1-2-12-33(13-3-1)35-22-25-36(26-23-35)49-44-20-10-11-21-45(44)50(40-27-24-34-14-4-5-15-37(34)30-40)48-32-39(28-29-46(48)49)47-31-38-16-6-7-17-41(38)42-18-8-9-19-43(42)47/h5-32H,1-4H3;2*3-32H,1-2H3;1-32H.

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

2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene has a molecular weight of 2619.42 g/mol, XLogP of 57.12, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 2,10-bis(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-ylanthracene;2-(9,9-dimethylfluoren-2-yl)-9-naphthalen-2-yl-10-(4-phenylphenyl)anthracene;10-(9,9-dimethylfluoren-2-yl)-9-naphthalen-1-yl-2-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenanthren-9-yl-10-(4-phenylphenyl)anthracene is sourced from PubChem (CID 162005752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).