About [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane
[(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane (PubChem CID 11383553) has the molecular formula C21H44O2Si2
and a molecular weight of 384.75 g/mol. Its IUPAC name is [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane.
Molecular Properties
| Compound Name | [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane |
| PubChem CID | 11383553 |
| Molecular Formula | C21H44O2Si2 |
| Molecular Weight | 384.75 g/mol |
| Exact Mass | 384.29 |
| IUPAC Name | [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane |
| SMILES | C=CO[C@@H](CCO[Si](C(C)C)(C(C)C)C(C)C)CC(=C)C[Si](C)(C)C |
| InChI | InChI=1S/C21H44O2Si2/c1-12-22-21(15-20(8)16-24(9,10)11)13-14-23-25(17(2)3,18(4)5)19(6)7/h12,17-19,21H,1,8,13-16H2,2-7,9-11H3/t21-/m0/s1 |
| InChIKey | LSANBZATAOPMMQ-NRFANRHFSA-N |
| XLogP | 7.38 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 384.75 |
| LogP ≤ 5 | 7.38 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane?
The IUPAC name of [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane (CID 11383553) is [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane.
What is the SMILES notation for [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane?
The canonical SMILES for [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane is C=CO[C@@H](CCO[Si](C(C)C)(C(C)C)C(C)C)CC(=C)C[Si](C)(C)C.
What is the InChIKey of [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane?
The InChIKey is LSANBZATAOPMMQ-NRFANRHFSA-N. The full InChI is InChI=1S/C21H44O2Si2/c1-12-22-21(15-20(8)16-24(9,10)11)13-14-23-25(17(2)3,18(4)5)19(6)7/h12,17-19,21H,1,8,13-16H2,2-7,9-11H3/t21-/m0/s1.
What are the key properties of [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane?
[(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane has a molecular weight of 384.75 g/mol, XLogP of 7.38, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-4-ethenoxy-2-methylidene-6-tri(propan-2-yl)silyloxyhexyl]-trimethylsilane is sourced from PubChem (CID 11383553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).