About trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane
trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane (PubChem CID 58151270) has the molecular formula C43H34Si
and a molecular weight of 578.83 g/mol. Its IUPAC name is trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane.
Molecular Properties
| Compound Name | trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane |
| PubChem CID | 58151270 |
| Molecular Formula | C43H34Si |
| Molecular Weight | 578.83 g/mol |
| Exact Mass | 578.24 |
| IUPAC Name | trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane |
| SMILES | C[Si](C)(C)c1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc34)ccc2c1 |
| InChI | InChI=1S/C43H34Si/c1-44(2,3)37-25-24-34-27-36(23-22-35(34)28-37)43-40-14-8-6-12-38(40)42(39-13-7-9-15-41(39)43)31-19-16-30(17-20-31)33-21-18-29-10-4-5-11-32(29)26-33/h4-28H,1-3H3 |
| InChIKey | UEJDYTOGVUQXLJ-UHFFFAOYSA-N |
| XLogP | 11.85 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 44 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 578.83 |
| LogP ≤ 5 | 11.85 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane?
The IUPAC name of trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane (CID 58151270) is trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane.
What is the SMILES notation for trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane?
The canonical SMILES for trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane is C[Si](C)(C)c1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc34)ccc2c1.
What is the InChIKey of trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane?
The InChIKey is UEJDYTOGVUQXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H34Si/c1-44(2,3)37-25-24-34-27-36(23-22-35(34)28-37)43-40-14-8-6-12-38(40)42(39-13-7-9-15-41(39)43)31-19-16-30(17-20-31)33-21-18-29-10-4-5-11-32(29)26-33/h4-28H,1-3H3.
What are the key properties of trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane?
trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane has a molecular weight of 578.83 g/mol, XLogP of 11.85, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane is sourced from PubChem (CID 58151270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).