About tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane
tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane (PubChem CID 101129918) has the molecular formula C25H52Si3
and a molecular weight of 436.95 g/mol. Its IUPAC name is tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane.
Molecular Properties
| Compound Name | tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane |
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| PubChem CID | 101129918 |
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| Molecular Formula | C25H52Si3 |
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| Molecular Weight | 436.95 g/mol |
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| Exact Mass | 436.34 |
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| IUPAC Name | tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane |
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| SMILES | CC(C)(C)C1=C(C(C)(C)C)C(=[Si]([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)CC1 |
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| InChI | InChI=1S/C25H52Si3/c1-22(2,3)19-17-18-20(21(19)23(4,5)6)26(27(13,14)24(7,8)9)28(15,16)25(10,11)12/h17-18H2,1-16H3 |
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| InChIKey | NFNCRTZPMAYEHC-UHFFFAOYSA-N |
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| XLogP | 8.59 |
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| TPSA | 0.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | |
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| Rotatable Bonds | 2 |
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| Heavy Atoms | 28 |
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| Complexity | — |
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Lipinski Rule of Five
1 violation
| Rule | Value |
|---|
| MW ≤ 500 | 436.95 |
| LogP ≤ 5 | 8.59 |
| 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 tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane?
The IUPAC name of tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane (CID 101129918) is tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane is CC(C)(C)C1=C(C(C)(C)C)C(=[Si]([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane?
The InChIKey is NFNCRTZPMAYEHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H52Si3/c1-22(2,3)19-17-18-20(21(19)23(4,5)6)26(27(13,14)24(7,8)9)28(15,16)25(10,11)12/h17-18H2,1-16H3.
What are the key properties of tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane?
tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane has a molecular weight of 436.95 g/mol, XLogP of 8.59, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane is sourced from PubChem (CID 101129918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).