About ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate
ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate (PubChem CID 158396193) has the molecular formula C12H40O6Si2
and a molecular weight of 336.62 g/mol. Its IUPAC name is ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate.
Molecular Properties
| Compound Name | ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate |
| PubChem CID | 158396193 |
| Molecular Formula | C12H40O6Si2 |
| Molecular Weight | 336.62 g/mol |
| Exact Mass | 336.24 |
| IUPAC Name | ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate |
| SMILES | C.C.CC[Si](C)(O)OC.CC[Si](C)(OC)OC.CO.O |
| InChI | InChI=1S/C5H14O2Si.C4H12O2Si.CH4O.2CH4.H2O/c1-5-8(4,6-2)7-3;1-4-7(3,5)6-2;1-2;;;/h5H2,1-4H3;5H,4H2,1-3H3;2H,1H3;2*1H4;1H2 |
| InChIKey | SBBWTNJQJAYSLG-UHFFFAOYSA-N |
| XLogP | 2.14 |
| TPSA | 99.65 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 336.62 |
| LogP ≤ 5 | 2.14 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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 ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
The IUPAC name of ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate (CID 158396193) is ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate.
What is the SMILES notation for ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
The canonical SMILES for ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate is C.C.CC[Si](C)(O)OC.CC[Si](C)(OC)OC.CO.O.
What is the InChIKey of ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
The InChIKey is SBBWTNJQJAYSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14O2Si.C4H12O2Si.CH4O.2CH4.H2O/c1-5-8(4,6-2)7-3;1-4-7(3,5)6-2;1-2;;;/h5H2,1-4H3;5H,4H2,1-3H3;2H,1H3;2*1H4;1H2.
What are the key properties of ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate?
ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate has a molecular weight of 336.62 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethoxy-methylsilane;ethyl-hydroxy-methoxy-methylsilane;methane;methanol;hydrate is sourced from PubChem (CID 158396193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).