About 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol
2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol (PubChem CID 4152421) has the molecular formula C7H18O3Si
and a molecular weight of 178.30 g/mol. Its IUPAC name is 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol.
Molecular Properties
| Compound Name | 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol |
|---|
| PubChem CID | 4152421 |
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| Molecular Formula | C7H18O3Si |
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| Molecular Weight | 178.30 g/mol |
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| Exact Mass | 178.10 |
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| IUPAC Name | 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol |
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| SMILES | C[Si](C)(O)CCCOCCO |
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| InChI | InChI=1S/C7H18O3Si/c1-11(2,9)7-3-5-10-6-4-8/h8-9H,3-7H2,1-2H3 |
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| InChIKey | VWRAYTJZZYWDEX-UHFFFAOYSA-N |
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| XLogP | 0.58 |
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| TPSA | 49.69 Ų |
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| H-Bond Donors | 2 |
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| H-Bond Acceptors | 3 |
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| Rotatable Bonds | 6 |
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| Heavy Atoms | 11 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 178.30 |
| LogP ≤ 5 | 0.58 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol?
The IUPAC name of 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol (CID 4152421) is 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol.
What is the SMILES notation for 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol?
The canonical SMILES for 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol is C[Si](C)(O)CCCOCCO.
What is the InChIKey of 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol?
The InChIKey is VWRAYTJZZYWDEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O3Si/c1-11(2,9)7-3-5-10-6-4-8/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol?
2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol has a molecular weight of 178.30 g/mol, XLogP of 0.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[hydroxy(dimethyl)silyl]propoxy]ethanol is sourced from PubChem (CID 4152421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).