About 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol
3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol (PubChem CID 173293784) has the molecular formula C6H22O2SSi4
and a molecular weight of 270.65 g/mol. Its IUPAC name is 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol.
Molecular Properties
| Compound Name | 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol |
| PubChem CID | 173293784 |
| Molecular Formula | C6H22O2SSi4 |
| Molecular Weight | 270.65 g/mol |
| Exact Mass | 270.04 |
| IUPAC Name | 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol |
| SMILES | C[SiH](CCCS)O[SiH2][Si](C)(C)O[SiH3] |
| InChI | InChI=1S/C6H22O2SSi4/c1-12(6-4-5-9)8-11-13(2,3)7-10/h9,12H,4-6,11H2,1-3,10H3 |
| InChIKey | JGDXVXVDNHKNBM-UHFFFAOYSA-N |
| XLogP | -0.24 |
| TPSA | 18.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.65 |
| LogP ≤ 5 | -0.24 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
The IUPAC name of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol (CID 173293784) is 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol.
What is the SMILES notation for 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
The canonical SMILES for 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol is C[SiH](CCCS)O[SiH2][Si](C)(C)O[SiH3].
What is the InChIKey of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
The InChIKey is JGDXVXVDNHKNBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H22O2SSi4/c1-12(6-4-5-9)8-11-13(2,3)7-10/h9,12H,4-6,11H2,1-3,10H3.
What are the key properties of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol has a molecular weight of 270.65 g/mol, XLogP of -0.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol is sourced from PubChem (CID 173293784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).