About trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane
trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane (PubChem CID 101156945) has the molecular formula C13H16Si
and a molecular weight of 200.36 g/mol. Its IUPAC name is trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane.
Molecular Properties
| Compound Name | trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane |
| PubChem CID | 101156945 |
| Molecular Formula | C13H16Si |
| Molecular Weight | 200.36 g/mol |
| Exact Mass | 200.10 |
| IUPAC Name | trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane |
| SMILES | C[Si](C)(C)/C=C\C#Cc1ccccc1 |
| InChI | InChI=1S/C13H16Si/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-6,8-10,12H,1-3H3/b12-8- |
| InChIKey | CPHKGGDEWFTXHI-WQLSENKSSA-N |
| XLogP | 3.47 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.36 |
| LogP ≤ 5 | 3.47 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
The IUPAC name of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane (CID 101156945) is trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane.
What is the SMILES notation for trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
The canonical SMILES for trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane is C[Si](C)(C)/C=C\C#Cc1ccccc1.
What is the InChIKey of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
The InChIKey is CPHKGGDEWFTXHI-WQLSENKSSA-N. The full InChI is InChI=1S/C13H16Si/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-6,8-10,12H,1-3H3/b12-8-.
What are the key properties of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane has a molecular weight of 200.36 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane is sourced from PubChem (CID 101156945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).