About (Z)-2-trimethylsilylnon-2-enenitrile
(Z)-2-trimethylsilylnon-2-enenitrile (PubChem CID 12848321) has the molecular formula C12H23NSi
and a molecular weight of 209.41 g/mol. Its IUPAC name is (Z)-2-trimethylsilylnon-2-enenitrile.
Molecular Properties
| Compound Name | (Z)-2-trimethylsilylnon-2-enenitrile |
| PubChem CID | 12848321 |
| Molecular Formula | C12H23NSi |
| Molecular Weight | 209.41 g/mol |
| Exact Mass | 209.16 |
| IUPAC Name | (Z)-2-trimethylsilylnon-2-enenitrile |
| SMILES | CCCCCC/C=C(/C#N)[Si](C)(C)C |
| InChI | InChI=1S/C12H23NSi/c1-5-6-7-8-9-10-12(11-13)14(2,3)4/h10H,5-9H2,1-4H3/b12-10- |
| InChIKey | KXSKZKYFNUFANF-BENRWUELSA-N |
| XLogP | 4.28 |
| TPSA | 23.79 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.41 |
| LogP ≤ 5 | 4.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'conjugated_nitrile_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (Z)-2-trimethylsilylnon-2-enenitrile?
The IUPAC name of (Z)-2-trimethylsilylnon-2-enenitrile (CID 12848321) is (Z)-2-trimethylsilylnon-2-enenitrile.
What is the SMILES notation for (Z)-2-trimethylsilylnon-2-enenitrile?
The canonical SMILES for (Z)-2-trimethylsilylnon-2-enenitrile is CCCCCC/C=C(/C#N)[Si](C)(C)C.
What is the InChIKey of (Z)-2-trimethylsilylnon-2-enenitrile?
The InChIKey is KXSKZKYFNUFANF-BENRWUELSA-N. The full InChI is InChI=1S/C12H23NSi/c1-5-6-7-8-9-10-12(11-13)14(2,3)4/h10H,5-9H2,1-4H3/b12-10-.
What are the key properties of (Z)-2-trimethylsilylnon-2-enenitrile?
(Z)-2-trimethylsilylnon-2-enenitrile has a molecular weight of 209.41 g/mol, XLogP of 4.28, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-trimethylsilylnon-2-enenitrile is sourced from PubChem (CID 12848321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).