About trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane
trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane (PubChem CID 11791627) has the molecular formula C15H26OSi
and a molecular weight of 250.46 g/mol. Its IUPAC name is trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane.
Molecular Properties
| Compound Name | trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane |
| PubChem CID | 11791627 |
| Molecular Formula | C15H26OSi |
| Molecular Weight | 250.46 g/mol |
| Exact Mass | 250.18 |
| IUPAC Name | trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane |
| SMILES | C=CCC1(OCC#C[Si](C)(C)C)CCCCC1 |
| InChI | InChI=1S/C15H26OSi/c1-5-10-15(11-7-6-8-12-15)16-13-9-14-17(2,3)4/h5H,1,6-8,10-13H2,2-4H3 |
| InChIKey | IWECXOVGKBCGDU-UHFFFAOYSA-N |
| XLogP | 4.16 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 250.46 |
| LogP ≤ 5 | 4.16 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane?
The IUPAC name of trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane (CID 11791627) is trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane.
What is the SMILES notation for trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane?
The canonical SMILES for trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane is C=CCC1(OCC#C[Si](C)(C)C)CCCCC1.
What is the InChIKey of trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane?
The InChIKey is IWECXOVGKBCGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26OSi/c1-5-10-15(11-7-6-8-12-15)16-13-9-14-17(2,3)4/h5H,1,6-8,10-13H2,2-4H3.
What are the key properties of trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane?
trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane has a molecular weight of 250.46 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-(1-prop-2-enylcyclohexyl)oxyprop-1-ynyl]silane is sourced from PubChem (CID 11791627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).