About dimethyl-bis(2H-triazol-4-yl)silane
dimethyl-bis(2H-triazol-4-yl)silane (PubChem CID 22468100) has the molecular formula C6H10N6Si
and a molecular weight of 194.27 g/mol. Its IUPAC name is dimethyl-bis(2H-triazol-4-yl)silane.
Molecular Properties
| Compound Name | dimethyl-bis(2H-triazol-4-yl)silane |
| PubChem CID | 22468100 |
| Molecular Formula | C6H10N6Si |
| Molecular Weight | 194.27 g/mol |
| Exact Mass | 194.07 |
| IUPAC Name | dimethyl-bis(2H-triazol-4-yl)silane |
| SMILES | C[Si](C)(c1cn[nH]n1)c1cn[nH]n1 |
| InChI | InChI=1S/C6H10N6Si/c1-13(2,5-3-7-11-9-5)6-4-8-12-10-6/h3-4H,1-2H3,(H,7,9,11)(H,8,10,12) |
| InChIKey | UKKPQMYINZHYCP-UHFFFAOYSA-N |
| XLogP | -1.25 |
| TPSA | 83.14 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 194.27 |
| LogP ≤ 5 | -1.25 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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 dimethyl-bis(2H-triazol-4-yl)silane?
The IUPAC name of dimethyl-bis(2H-triazol-4-yl)silane (CID 22468100) is dimethyl-bis(2H-triazol-4-yl)silane.
What is the SMILES notation for dimethyl-bis(2H-triazol-4-yl)silane?
The canonical SMILES for dimethyl-bis(2H-triazol-4-yl)silane is C[Si](C)(c1cn[nH]n1)c1cn[nH]n1.
What is the InChIKey of dimethyl-bis(2H-triazol-4-yl)silane?
The InChIKey is UKKPQMYINZHYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N6Si/c1-13(2,5-3-7-11-9-5)6-4-8-12-10-6/h3-4H,1-2H3,(H,7,9,11)(H,8,10,12).
What are the key properties of dimethyl-bis(2H-triazol-4-yl)silane?
dimethyl-bis(2H-triazol-4-yl)silane has a molecular weight of 194.27 g/mol, XLogP of -1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2H-triazol-4-yl)silane is sourced from PubChem (CID 22468100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).