About [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol
[dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol (PubChem CID 123571023) has the molecular formula C11H26O5Si
and a molecular weight of 266.41 g/mol. Its IUPAC name is [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol.
Molecular Properties
| Compound Name | [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol |
| PubChem CID | 123571023 |
| Molecular Formula | C11H26O5Si |
| Molecular Weight | 266.41 g/mol |
| Exact Mass | 266.15 |
| IUPAC Name | [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol |
| SMILES | COCC(C)COCCC[Si](CO)(OC)OC |
| InChI | InChI=1S/C11H26O5Si/c1-11(8-13-2)9-16-6-5-7-17(10-12,14-3)15-4/h11-12H,5-10H2,1-4H3 |
| InChIKey | BXOIVHURGSJRTK-UHFFFAOYSA-N |
| XLogP | 0.94 |
| TPSA | 57.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 266.41 |
| LogP ≤ 5 | 0.94 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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 [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol?
The IUPAC name of [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol (CID 123571023) is [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol.
What is the SMILES notation for [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol?
The canonical SMILES for [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol is COCC(C)COCCC[Si](CO)(OC)OC.
What is the InChIKey of [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol?
The InChIKey is BXOIVHURGSJRTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O5Si/c1-11(8-13-2)9-16-6-5-7-17(10-12,14-3)15-4/h11-12H,5-10H2,1-4H3.
What are the key properties of [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol?
[dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol has a molecular weight of 266.41 g/mol, XLogP of 0.94, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethoxy-[3-(3-methoxy-2-methylpropoxy)propyl]silyl]methanol is sourced from PubChem (CID 123571023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).