About trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane
trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane (PubChem CID 10958257) has the molecular formula C22H30Si
and a molecular weight of 322.57 g/mol. Its IUPAC name is trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane.
Molecular Properties
| Compound Name | trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane |
| PubChem CID | 10958257 |
| Molecular Formula | C22H30Si |
| Molecular Weight | 322.57 g/mol |
| Exact Mass | 322.21 |
| IUPAC Name | trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane |
| SMILES | C[Si](C)(C)CC=C(CCc1ccccc1)CCc1ccccc1 |
| InChI | InChI=1S/C22H30Si/c1-23(2,3)19-18-22(16-14-20-10-6-4-7-11-20)17-15-21-12-8-5-9-13-21/h4-13,18H,14-17,19H2,1-3H3 |
| InChIKey | SNJFPZVOJWQWRM-UHFFFAOYSA-N |
| XLogP | 6.52 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 8 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 322.57 |
| LogP ≤ 5 | 6.52 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane?
The IUPAC name of trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane (CID 10958257) is trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane.
What is the SMILES notation for trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane?
The canonical SMILES for trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane is C[Si](C)(C)CC=C(CCc1ccccc1)CCc1ccccc1.
What is the InChIKey of trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane?
The InChIKey is SNJFPZVOJWQWRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30Si/c1-23(2,3)19-18-22(16-14-20-10-6-4-7-11-20)17-15-21-12-8-5-9-13-21/h4-13,18H,14-17,19H2,1-3H3.
What are the key properties of trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane?
trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane has a molecular weight of 322.57 g/mol, XLogP of 6.52, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane is sourced from PubChem (CID 10958257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).