About [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane
[bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane (PubChem CID 15400268) has the molecular formula C25H61Cl3Si6
and a molecular weight of 636.64 g/mol. Its IUPAC name is [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane.
Molecular Properties
| Compound Name | [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane |
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| PubChem CID | 15400268 |
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| Molecular Formula | C25H61Cl3Si6 |
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| Molecular Weight | 636.64 g/mol |
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| Exact Mass | 634.25 |
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| IUPAC Name | [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane |
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| SMILES | CC(C)(C)[Si](C)(C)[Si](Cl)([Si](C)(C)C(C)(C)C)[Si](C(Cl)Cl)([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C |
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| InChI | InChI=1S/C25H61Cl3Si6/c1-22(2,3)29(13,14)33(21(26)27,30(15,16)23(4,5)6)34(28,31(17,18)24(7,8)9)32(19,20)25(10,11)12/h21H,1-20H3 |
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| InChIKey | NVAAIPWKGIWEFD-UHFFFAOYSA-N |
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| XLogP | 11.39 |
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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 | 6 |
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| Heavy Atoms | 34 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
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| MW ≤ 500 | 636.64 |
| LogP ≤ 5 | 11.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane?
The IUPAC name of [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane (CID 15400268) is [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane.
What is the SMILES notation for [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane?
The canonical SMILES for [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane is CC(C)(C)[Si](C)(C)[Si](Cl)([Si](C)(C)C(C)(C)C)[Si](C(Cl)Cl)([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane?
The InChIKey is NVAAIPWKGIWEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H61Cl3Si6/c1-22(2,3)29(13,14)33(21(26)27,30(15,16)23(4,5)6)34(28,31(17,18)24(7,8)9)32(19,20)25(10,11)12/h21H,1-20H3.
What are the key properties of [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane?
[bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane has a molecular weight of 636.64 g/mol, XLogP of 11.39, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [bis[tert-butyl(dimethyl)silyl]-chlorosilyl]-bis[tert-butyl(dimethyl)silyl]-(dichloromethyl)silane is sourced from PubChem (CID 15400268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).