About [(E)-3-methoxyprop-1-enyl]-triphenylsilane
[(E)-3-methoxyprop-1-enyl]-triphenylsilane (PubChem CID 102399031) has the molecular formula C22H22OSi
and a molecular weight of 330.50 g/mol. Its IUPAC name is [(E)-3-methoxyprop-1-enyl]-triphenylsilane.
Molecular Properties
| Compound Name | [(E)-3-methoxyprop-1-enyl]-triphenylsilane |
| PubChem CID | 102399031 |
| Molecular Formula | C22H22OSi |
| Molecular Weight | 330.50 g/mol |
| Exact Mass | 330.14 |
| IUPAC Name | [(E)-3-methoxyprop-1-enyl]-triphenylsilane |
| SMILES | COC/C=C/[Si](c1ccccc1)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C22H22OSi/c1-23-18-11-19-24(20-12-5-2-6-13-20,21-14-7-3-8-15-21)22-16-9-4-10-17-22/h2-17,19H,18H2,1H3/b19-11+ |
| InChIKey | FXUXVLBIPPUPLE-YBFXNURJSA-N |
| XLogP | 2.90 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 330.50 |
| LogP ≤ 5 | 2.90 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
|---|
Analyze [(E)-3-methoxyprop-1-enyl]-triphenylsilane 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 [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
The IUPAC name of [(E)-3-methoxyprop-1-enyl]-triphenylsilane (CID 102399031) is [(E)-3-methoxyprop-1-enyl]-triphenylsilane.
What is the SMILES notation for [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
The canonical SMILES for [(E)-3-methoxyprop-1-enyl]-triphenylsilane is COC/C=C/[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
The InChIKey is FXUXVLBIPPUPLE-YBFXNURJSA-N. The full InChI is InChI=1S/C22H22OSi/c1-23-18-11-19-24(20-12-5-2-6-13-20,21-14-7-3-8-15-21)22-16-9-4-10-17-22/h2-17,19H,18H2,1H3/b19-11+.
What are the key properties of [(E)-3-methoxyprop-1-enyl]-triphenylsilane?
[(E)-3-methoxyprop-1-enyl]-triphenylsilane has a molecular weight of 330.50 g/mol, XLogP of 2.90, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-methoxyprop-1-enyl]-triphenylsilane is sourced from PubChem (CID 102399031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).