About [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane
[1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane (PubChem CID 15864317) has the molecular formula C15H37P3Si4
and a molecular weight of 422.73 g/mol. Its IUPAC name is [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane.
Molecular Properties
| Compound Name | [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane |
| PubChem CID | 15864317 |
| Molecular Formula | C15H37P3Si4 |
| Molecular Weight | 422.73 g/mol |
| Exact Mass | 422.12 |
| IUPAC Name | [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane |
| SMILES | C[Si](C)(C)c1pc([Si](C)(C)C)p(C([Si](C)(C)C)[Si](C)(C)C)p1 |
| InChI | InChI=1S/C15H37P3Si4/c1-19(2,3)13-16-14(20(4,5)6)18(17-13)15(21(7,8)9)22(10,11)12/h15H,1-12H3 |
| InChIKey | XMFACWKCXOATDZ-UHFFFAOYSA-N |
| XLogP | 7.22 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 422.73 |
| LogP ≤ 5 | 7.22 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane?
The IUPAC name of [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane (CID 15864317) is [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane.
What is the SMILES notation for [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane?
The canonical SMILES for [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane is C[Si](C)(C)c1pc([Si](C)(C)C)p(C([Si](C)(C)C)[Si](C)(C)C)p1.
What is the InChIKey of [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane?
The InChIKey is XMFACWKCXOATDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H37P3Si4/c1-19(2,3)13-16-14(20(4,5)6)18(17-13)15(21(7,8)9)22(10,11)12/h15H,1-12H3.
What are the key properties of [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane?
[1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane has a molecular weight of 422.73 g/mol, XLogP of 7.22, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[bis(trimethylsilyl)methyl]-5-trimethylsilyl-1,2,4-triphosphol-3-yl]-trimethylsilane is sourced from PubChem (CID 15864317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).