About ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane
ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane (PubChem CID 12521013) has the molecular formula C8H16OSi
and a molecular weight of 156.30 g/mol. Its IUPAC name is ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane.
Molecular Properties
| Compound Name | ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane |
| PubChem CID | 12521013 |
| Molecular Formula | C8H16OSi |
| Molecular Weight | 156.30 g/mol |
| Exact Mass | 156.10 |
| IUPAC Name | ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane |
| SMILES | C#C[Si](C)(C)OC(C)(C)C |
| InChI | InChI=1S/C8H16OSi/c1-7-10(5,6)9-8(2,3)4/h1H,2-6H3 |
| InChIKey | ZNMUTQWRWAXKEW-UHFFFAOYSA-N |
| XLogP | 2.18 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 156.30 |
| LogP ≤ 5 | 2.18 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane?
The IUPAC name of ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane (CID 12521013) is ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane.
What is the SMILES notation for ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane?
The canonical SMILES for ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane is C#C[Si](C)(C)OC(C)(C)C.
What is the InChIKey of ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane?
The InChIKey is ZNMUTQWRWAXKEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16OSi/c1-7-10(5,6)9-8(2,3)4/h1H,2-6H3.
What are the key properties of ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane?
ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane has a molecular weight of 156.30 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane is sourced from PubChem (CID 12521013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).