About bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane
bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane (PubChem CID 137329639) has the molecular formula C48H62OSi2
and a molecular weight of 711.20 g/mol. Its IUPAC name is bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane.
Molecular Properties
| Compound Name | bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane |
| PubChem CID | 137329639 |
| Molecular Formula | C48H62OSi2 |
| Molecular Weight | 711.20 g/mol |
| Exact Mass | 710.43 |
| IUPAC Name | bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane |
| SMILES | c1ccc([SiH](O[SiH](c2ccccc2C2CCCCC2)c2ccccc2C2CCCCC2)c2ccccc2C2CCCCC2)c(C2CCCCC2)c1 |
| InChI | InChI=1S/C48H62OSi2/c1-5-21-37(22-6-1)41-29-13-17-33-45(41)50(46-34-18-14-30-42(46)38-23-7-2-8-24-38)49-51(47-35-19-15-31-43(47)39-25-9-3-10-26-39)48-36-20-16-32-44(48)40-27-11-4-12-28-40/h13-20,29-40,50-51H,1-12,21-28H2 |
| InChIKey | PLWILPBPBOMXKA-UHFFFAOYSA-N |
| XLogP | 10.27 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 51 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 711.20 |
| LogP ≤ 5 | 10.27 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane?
The IUPAC name of bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane (CID 137329639) is bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane.
What is the SMILES notation for bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane?
The canonical SMILES for bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane is c1ccc([SiH](O[SiH](c2ccccc2C2CCCCC2)c2ccccc2C2CCCCC2)c2ccccc2C2CCCCC2)c(C2CCCCC2)c1.
What is the InChIKey of bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane?
The InChIKey is PLWILPBPBOMXKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H62OSi2/c1-5-21-37(22-6-1)41-29-13-17-33-45(41)50(46-34-18-14-30-42(46)38-23-7-2-8-24-38)49-51(47-35-19-15-31-43(47)39-25-9-3-10-26-39)48-36-20-16-32-44(48)40-27-11-4-12-28-40/h13-20,29-40,50-51H,1-12,21-28H2.
What are the key properties of bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane?
bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane has a molecular weight of 711.20 g/mol, XLogP of 10.27, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-cyclohexylphenyl)silyloxy-bis(2-cyclohexylphenyl)silane is sourced from PubChem (CID 137329639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).