About (4-butylphenyl)methyl-dimethyl-phenylsilane
(4-butylphenyl)methyl-dimethyl-phenylsilane (PubChem CID 10636667) has the molecular formula C19H26Si
and a molecular weight of 282.50 g/mol. Its IUPAC name is (4-butylphenyl)methyl-dimethyl-phenylsilane.
Molecular Properties
| Compound Name | (4-butylphenyl)methyl-dimethyl-phenylsilane |
| PubChem CID | 10636667 |
| Molecular Formula | C19H26Si |
| Molecular Weight | 282.50 g/mol |
| Exact Mass | 282.18 |
| IUPAC Name | (4-butylphenyl)methyl-dimethyl-phenylsilane |
| SMILES | CCCCc1ccc(C[Si](C)(C)c2ccccc2)cc1 |
| InChI | InChI=1S/C19H26Si/c1-4-5-9-17-12-14-18(15-13-17)16-20(2,3)19-10-7-6-8-11-19/h6-8,10-15H,4-5,9,16H2,1-3H3 |
| InChIKey | DSLWDGYQRWIYRI-UHFFFAOYSA-N |
| XLogP | 4.73 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 6 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 282.50 |
| LogP ≤ 5 | 4.73 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 (4-butylphenyl)methyl-dimethyl-phenylsilane?
The IUPAC name of (4-butylphenyl)methyl-dimethyl-phenylsilane (CID 10636667) is (4-butylphenyl)methyl-dimethyl-phenylsilane.
What is the SMILES notation for (4-butylphenyl)methyl-dimethyl-phenylsilane?
The canonical SMILES for (4-butylphenyl)methyl-dimethyl-phenylsilane is CCCCc1ccc(C[Si](C)(C)c2ccccc2)cc1.
What is the InChIKey of (4-butylphenyl)methyl-dimethyl-phenylsilane?
The InChIKey is DSLWDGYQRWIYRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26Si/c1-4-5-9-17-12-14-18(15-13-17)16-20(2,3)19-10-7-6-8-11-19/h6-8,10-15H,4-5,9,16H2,1-3H3.
What are the key properties of (4-butylphenyl)methyl-dimethyl-phenylsilane?
(4-butylphenyl)methyl-dimethyl-phenylsilane has a molecular weight of 282.50 g/mol, XLogP of 4.73, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-butylphenyl)methyl-dimethyl-phenylsilane is sourced from PubChem (CID 10636667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).