About 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole
2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole (PubChem CID 137474165) has the molecular formula C48H29NO2
and a molecular weight of 651.77 g/mol. Its IUPAC name is 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole.
Molecular Properties
| Compound Name | 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole |
| PubChem CID | 137474165 |
| Molecular Formula | C48H29NO2 |
| Molecular Weight | 651.77 g/mol |
| Exact Mass | 651.22 |
| IUPAC Name | 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole |
| SMILES | c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7cccc8c7oc7ccccc78)cc6)c5c4)cc3)cc12 |
| InChI | InChI=1S/C48H29NO2/c1-4-13-43-37(8-1)38-26-22-34(31-18-16-30(17-19-31)33-23-27-47-42(28-33)40-10-3-5-14-45(40)50-47)29-44(38)49(43)35-24-20-32(21-25-35)36-11-7-12-41-39-9-2-6-15-46(39)51-48(36)41/h1-29H |
| InChIKey | GAENVQXBKVYSFO-UHFFFAOYSA-N |
| XLogP | 13.58 |
| TPSA | 31.21 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 51 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 651.77 |
| LogP ≤ 5 | 13.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole?
The IUPAC name of 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole (CID 137474165) is 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole.
What is the SMILES notation for 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole?
The canonical SMILES for 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole is c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7cccc8c7oc7ccccc78)cc6)c5c4)cc3)cc12.
What is the InChIKey of 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole?
The InChIKey is GAENVQXBKVYSFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H29NO2/c1-4-13-43-37(8-1)38-26-22-34(31-18-16-30(17-19-31)33-23-27-47-42(28-33)40-10-3-5-14-45(40)50-47)29-44(38)49(43)35-24-20-32(21-25-35)36-11-7-12-41-39-9-2-6-15-46(39)51-48(36)41/h1-29H.
What are the key properties of 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole?
2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole has a molecular weight of 651.77 g/mol, XLogP of 13.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole is sourced from PubChem (CID 137474165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).