About 1,3-Dimethyldiisobutyldisiloxane
1,3-Dimethyldiisobutyldisiloxane (PubChem CID 14025993) has the molecular formula C10H24OSi2
and a molecular weight of 216.47 g/mol.
Molecular Properties
| Compound Name | 1,3-Dimethyldiisobutyldisiloxane |
| PubChem CID | 14025993 |
| Molecular Formula | C10H24OSi2 |
| Molecular Weight | 216.47 g/mol |
| Exact Mass | 216.14 |
| IUPAC Name | — |
| SMILES | CC(C)C[Si](C)O[Si](C)CC(C)C |
| InChI | InChI=1S/C10H24OSi2/c1-9(2)7-12(5)11-13(6)8-10(3)4/h9-10H,7-8H2,1-6H3 |
| InChIKey | XOCZWDVENMEROF-UHFFFAOYSA-N |
| XLogP | 3.56 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 216.47 |
| LogP ≤ 5 | 3.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 1,3-Dimethyldiisobutyldisiloxane?
The IUPAC name of 1,3-Dimethyldiisobutyldisiloxane (CID 14025993) is not available.
What is the SMILES notation for 1,3-Dimethyldiisobutyldisiloxane?
The canonical SMILES for 1,3-Dimethyldiisobutyldisiloxane is CC(C)C[Si](C)O[Si](C)CC(C)C.
What is the InChIKey of 1,3-Dimethyldiisobutyldisiloxane?
The InChIKey is XOCZWDVENMEROF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24OSi2/c1-9(2)7-12(5)11-13(6)8-10(3)4/h9-10H,7-8H2,1-6H3.
What are the key properties of 1,3-Dimethyldiisobutyldisiloxane?
1,3-Dimethyldiisobutyldisiloxane has a molecular weight of 216.47 g/mol, XLogP of 3.56, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-Dimethyldiisobutyldisiloxane is sourced from PubChem (CID 14025993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).