About methyl 2-hydroxy-3-triethylsilylpropanoate
methyl 2-hydroxy-3-triethylsilylpropanoate (PubChem CID 10921993) has the molecular formula C10H22O3Si
and a molecular weight of 218.37 g/mol. Its IUPAC name is methyl 2-hydroxy-3-triethylsilylpropanoate.
Molecular Properties
| Compound Name | methyl 2-hydroxy-3-triethylsilylpropanoate |
| PubChem CID | 10921993 |
| Molecular Formula | C10H22O3Si |
| Molecular Weight | 218.37 g/mol |
| Exact Mass | 218.13 |
| IUPAC Name | methyl 2-hydroxy-3-triethylsilylpropanoate |
| SMILES | CC[Si](CC)(CC)CC(O)C(=O)OC |
| InChI | InChI=1S/C10H22O3Si/c1-5-14(6-2,7-3)8-9(11)10(12)13-4/h9,11H,5-8H2,1-4H3 |
| InChIKey | HXSKYMNPPKMPPD-UHFFFAOYSA-N |
| XLogP | 2.03 |
| TPSA | 46.53 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 218.37 |
| LogP ≤ 5 | 2.03 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of methyl 2-hydroxy-3-triethylsilylpropanoate?
The IUPAC name of methyl 2-hydroxy-3-triethylsilylpropanoate (CID 10921993) is methyl 2-hydroxy-3-triethylsilylpropanoate.
What is the SMILES notation for methyl 2-hydroxy-3-triethylsilylpropanoate?
The canonical SMILES for methyl 2-hydroxy-3-triethylsilylpropanoate is CC[Si](CC)(CC)CC(O)C(=O)OC.
What is the InChIKey of methyl 2-hydroxy-3-triethylsilylpropanoate?
The InChIKey is HXSKYMNPPKMPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3Si/c1-5-14(6-2,7-3)8-9(11)10(12)13-4/h9,11H,5-8H2,1-4H3.
What are the key properties of methyl 2-hydroxy-3-triethylsilylpropanoate?
methyl 2-hydroxy-3-triethylsilylpropanoate has a molecular weight of 218.37 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-hydroxy-3-triethylsilylpropanoate is sourced from PubChem (CID 10921993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).