About di(carbazol-9-yl)-diphenylsilane
di(carbazol-9-yl)-diphenylsilane (PubChem CID 58651816) has the molecular formula C36H26N2Si
and a molecular weight of 514.70 g/mol. Its IUPAC name is di(carbazol-9-yl)-diphenylsilane.
Molecular Properties
| Compound Name | di(carbazol-9-yl)-diphenylsilane |
| PubChem CID | 58651816 |
| Molecular Formula | C36H26N2Si |
| Molecular Weight | 514.70 g/mol |
| Exact Mass | 514.19 |
| IUPAC Name | di(carbazol-9-yl)-diphenylsilane |
| SMILES | c1ccc([Si](c2ccccc2)(n2c3ccccc3c3ccccc32)n2c3ccccc3c3ccccc32)cc1 |
| InChI | InChI=1S/C36H26N2Si/c1-3-15-27(16-4-1)39(28-17-5-2-6-18-28,37-33-23-11-7-19-29(33)30-20-8-12-24-34(30)37)38-35-25-13-9-21-31(35)32-22-10-14-26-36(32)38/h1-26H |
| InChIKey | FXUJLIDGDDDVES-UHFFFAOYSA-N |
| XLogP | 7.56 |
| TPSA | 9.86 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 39 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 514.70 |
| LogP ≤ 5 | 7.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of di(carbazol-9-yl)-diphenylsilane?
The IUPAC name of di(carbazol-9-yl)-diphenylsilane (CID 58651816) is di(carbazol-9-yl)-diphenylsilane.
What is the SMILES notation for di(carbazol-9-yl)-diphenylsilane?
The canonical SMILES for di(carbazol-9-yl)-diphenylsilane is c1ccc([Si](c2ccccc2)(n2c3ccccc3c3ccccc32)n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of di(carbazol-9-yl)-diphenylsilane?
The InChIKey is FXUJLIDGDDDVES-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N2Si/c1-3-15-27(16-4-1)39(28-17-5-2-6-18-28,37-33-23-11-7-19-29(33)30-20-8-12-24-34(30)37)38-35-25-13-9-21-31(35)32-22-10-14-26-36(32)38/h1-26H.
What are the key properties of di(carbazol-9-yl)-diphenylsilane?
di(carbazol-9-yl)-diphenylsilane has a molecular weight of 514.70 g/mol, XLogP of 7.56, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for di(carbazol-9-yl)-diphenylsilane is sourced from PubChem (CID 58651816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).