About (3-chlorophenyl)-methyl-diphenylsilane
(3-chlorophenyl)-methyl-diphenylsilane (PubChem CID 101069802) has the molecular formula C19H17ClSi
and a molecular weight of 308.88 g/mol. Its IUPAC name is (3-chlorophenyl)-methyl-diphenylsilane.
Molecular Properties
| Compound Name | (3-chlorophenyl)-methyl-diphenylsilane |
| PubChem CID | 101069802 |
| Molecular Formula | C19H17ClSi |
| Molecular Weight | 308.88 g/mol |
| Exact Mass | 308.08 |
| IUPAC Name | (3-chlorophenyl)-methyl-diphenylsilane |
| SMILES | C[Si](c1ccccc1)(c1ccccc1)c1cccc(Cl)c1 |
| InChI | InChI=1S/C19H17ClSi/c1-21(17-10-4-2-5-11-17,18-12-6-3-7-13-18)19-14-8-9-16(20)15-19/h2-15H,1H3 |
| InChIKey | OILATJFWIZCIQG-UHFFFAOYSA-N |
| XLogP | 3.44 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 308.88 |
| LogP ≤ 5 | 3.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (3-chlorophenyl)-methyl-diphenylsilane?
The IUPAC name of (3-chlorophenyl)-methyl-diphenylsilane (CID 101069802) is (3-chlorophenyl)-methyl-diphenylsilane.
What is the SMILES notation for (3-chlorophenyl)-methyl-diphenylsilane?
The canonical SMILES for (3-chlorophenyl)-methyl-diphenylsilane is C[Si](c1ccccc1)(c1ccccc1)c1cccc(Cl)c1.
What is the InChIKey of (3-chlorophenyl)-methyl-diphenylsilane?
The InChIKey is OILATJFWIZCIQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClSi/c1-21(17-10-4-2-5-11-17,18-12-6-3-7-13-18)19-14-8-9-16(20)15-19/h2-15H,1H3.
What are the key properties of (3-chlorophenyl)-methyl-diphenylsilane?
(3-chlorophenyl)-methyl-diphenylsilane has a molecular weight of 308.88 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-methyl-diphenylsilane is sourced from PubChem (CID 101069802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).