About trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane
trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane (PubChem CID 102398386) has the molecular formula C18H30O2Si
and a molecular weight of 306.52 g/mol. Its IUPAC name is trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane.
Molecular Properties
| Compound Name | trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane |
| PubChem CID | 102398386 |
| Molecular Formula | C18H30O2Si |
| Molecular Weight | 306.52 g/mol |
| Exact Mass | 306.20 |
| IUPAC Name | trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane |
| SMILES | CC(C)C/C(=C(\OC(C)C)O[Si](C)(C)C)c1ccccc1 |
| InChI | InChI=1S/C18H30O2Si/c1-14(2)13-17(16-11-9-8-10-12-16)18(19-15(3)4)20-21(5,6)7/h8-12,14-15H,13H2,1-7H3/b18-17- |
| InChIKey | PLFSWFBJPFZJJZ-ZCXUNETKSA-N |
| XLogP | 5.68 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 306.52 |
| LogP ≤ 5 | 5.68 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane?
The IUPAC name of trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane (CID 102398386) is trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane.
What is the SMILES notation for trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane?
The canonical SMILES for trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane is CC(C)C/C(=C(\OC(C)C)O[Si](C)(C)C)c1ccccc1.
What is the InChIKey of trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane?
The InChIKey is PLFSWFBJPFZJJZ-ZCXUNETKSA-N. The full InChI is InChI=1S/C18H30O2Si/c1-14(2)13-17(16-11-9-8-10-12-16)18(19-15(3)4)20-21(5,6)7/h8-12,14-15H,13H2,1-7H3/b18-17-.
What are the key properties of trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane?
trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane has a molecular weight of 306.52 g/mol, XLogP of 5.68, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-4-methyl-2-phenyl-1-propan-2-yloxypent-1-enoxy]silane is sourced from PubChem (CID 102398386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).