About ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane
ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane (PubChem CID 86214718) has the molecular formula C13H20O2Si
and a molecular weight of 236.39 g/mol. Its IUPAC name is ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane.
Molecular Properties
| Compound Name | ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane |
| PubChem CID | 86214718 |
| Molecular Formula | C13H20O2Si |
| Molecular Weight | 236.39 g/mol |
| Exact Mass | 236.12 |
| IUPAC Name | ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane |
| SMILES | C=C[Si](C)(C)OCCOCc1ccccc1 |
| InChI | InChI=1S/C13H20O2Si/c1-4-16(2,3)15-11-10-14-12-13-8-6-5-7-9-13/h4-9H,1,10-12H2,2-3H3 |
| InChIKey | BLKGXNRJHSXMMC-UHFFFAOYSA-N |
| XLogP | 3.15 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.39 |
| LogP ≤ 5 | 3.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane?
The IUPAC name of ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane (CID 86214718) is ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane.
What is the SMILES notation for ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane?
The canonical SMILES for ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane is C=C[Si](C)(C)OCCOCc1ccccc1.
What is the InChIKey of ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane?
The InChIKey is BLKGXNRJHSXMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2Si/c1-4-16(2,3)15-11-10-14-12-13-8-6-5-7-9-13/h4-9H,1,10-12H2,2-3H3.
What are the key properties of ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane?
ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane has a molecular weight of 236.39 g/mol, XLogP of 3.15, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-dimethyl-(2-phenylmethoxyethoxy)silane is sourced from PubChem (CID 86214718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).