About 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene
9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene (PubChem CID 143848174) has the molecular formula C37H24
and a molecular weight of 468.60 g/mol. Its IUPAC name is 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene.
Molecular Properties
| Compound Name | 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene |
| PubChem CID | 143848174 |
| Molecular Formula | C37H24 |
| Molecular Weight | 468.60 g/mol |
| Exact Mass | 468.19 |
| IUPAC Name | 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene |
| SMILES | c1ccc2c(c1)Cc1ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc1-2 |
| InChI | InChI=1S/C37H24/c1-2-10-25-21-28(19-17-24(25)9-1)36-31-13-5-7-15-33(31)37(34-16-8-6-14-32(34)36)29-20-18-27-22-26-11-3-4-12-30(26)35(27)23-29/h1-21,23H,22H2 |
| InChIKey | MKRXLHVFDVIFDH-UHFFFAOYSA-N |
| XLogP | 10.05 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 37 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 468.60 |
| LogP ≤ 5 | 10.05 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene?
The IUPAC name of 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene (CID 143848174) is 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene.
What is the SMILES notation for 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene?
The canonical SMILES for 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene is c1ccc2c(c1)Cc1ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc1-2.
What is the InChIKey of 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene?
The InChIKey is MKRXLHVFDVIFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24/c1-2-10-25-21-28(19-17-24(25)9-1)36-31-13-5-7-15-33(31)37(34-16-8-6-14-32(34)36)29-20-18-27-22-26-11-3-4-12-30(26)35(27)23-29/h1-21,23H,22H2.
What are the key properties of 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene?
9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene has a molecular weight of 468.60 g/mol, XLogP of 10.05, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene is sourced from PubChem (CID 143848174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).