2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene

C105H74O — CID 158955634

About 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene

2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene (PubChem CID 158955634) has the molecular formula C105H74O and a molecular weight of 1351.75 g/mol. Its IUPAC name is 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene.

Molecular Properties

• Compound Name: 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene
• PubChem CID: 158955634
• Molecular Formula: C105H74O
• Molecular Weight: 1351.75 g/mol
• Exact Mass: 1350.57
• IUPAC Name: 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene
• SMILES: CC1(C)c2ccc3ccccc3c2-c2cccc(-c3cccc(-c4c5ccccc5c(-c5ccc6oc7ccccc7c6c5)c5ccccc45)c3)c21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc(-c5cccc6c5C(C)(C)c5ccc7ccccc7c5-6)c4)c4ccccc34)cc21
• InChI: InChI=1S/C54H40.C51H34O/c1-53(2)46-26-12-11-19-39(46)40-29-27-36(32-48(40)53)50-43-22-9-7-20-41(43)49(42-21-8-10-23-44(42)50)35-17-13-16-34(31-35)38-24-14-25-45-51-37-18-6-5-15-33(37)28-30-47(51)54(3,4)52(38)45;1-51(2)44-27-25-31-13-3-4-16-35(31)49(44)42-23-12-22-36(50(42)51)32-14-11-15-33(29-32)47-38-18-5-7-20-40(38)48(41-21-8-6-19-39(41)47)34-26-28-46-43(30-34)37-17-9-10-24-45(37)52-46/h5-32H,1-4H3;3-30H,1-2H3
• InChIKey: JLYWUJRKOCJGRE-UHFFFAOYSA-N
• XLogP: 29.11
• TPSA: 13.14 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 6
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1351.75
LogP ≤ 5	29.11
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene?

The IUPAC name of 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene (CID 158955634) is 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene.

What is the SMILES notation for 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene?

The canonical SMILES for 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene is CC1(C)c2ccc3ccccc3c2-c2cccc(-c3cccc(-c4c5ccccc5c(-c5ccc6oc7ccccc7c6c5)c5ccccc45)c3)c21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc(-c5cccc6c5C(C)(C)c5ccc7ccccc7c5-6)c4)c4ccccc34)cc21.

What is the InChIKey of 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene?

The InChIKey is JLYWUJRKOCJGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H40.C51H34O/c1-53(2)46-26-12-11-19-39(46)40-29-27-36(32-48(40)53)50-43-22-9-7-20-41(43)49(42-21-8-10-23-44(42)50)35-17-13-16-34(31-35)38-24-14-25-45-51-37-18-6-5-15-33(37)28-30-47(51)54(3,4)52(38)45;1-51(2)44-27-25-31-13-3-4-16-35(31)49(44)42-23-12-22-36(50(42)51)32-14-11-15-33(29-32)47-38-18-5-7-20-40(38)48(41-21-8-6-19-39(41)47)34-26-28-46-43(30-34)37-17-9-10-24-45(37)52-46/h5-32H,1-4H3;3-30H,1-2H3.

What are the key properties of 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene?

2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene has a molecular weight of 1351.75 g/mol, XLogP of 29.11, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[10-[3-(7,7-dimethylbenzo[g]fluoren-8-yl)phenyl]anthracen-9-yl]dibenzofuran;8-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]-7,7-dimethylbenzo[c]fluorene is sourced from PubChem (CID 158955634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).