About (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane
(2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane (PubChem CID 134877705) has the molecular formula C16H32Si
and a molecular weight of 252.52 g/mol. Its IUPAC name is (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane.
Molecular Properties
| Compound Name | (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane |
| PubChem CID | 134877705 |
| Molecular Formula | C16H32Si |
| Molecular Weight | 252.52 g/mol |
| Exact Mass | 252.23 |
| IUPAC Name | (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane |
| SMILES | CC1=C([Si](C(C)C)(C(C)C)C(C)C)CCCC1 |
| InChI | InChI=1S/C16H32Si/c1-12(2)17(13(3)4,14(5)6)16-11-9-8-10-15(16)7/h12-14H,8-11H2,1-7H3 |
| InChIKey | NUJXXTFOGUHYHJ-UHFFFAOYSA-N |
| XLogP | 6.09 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 252.52 |
| LogP ≤ 5 | 6.09 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane?
The IUPAC name of (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane (CID 134877705) is (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane.
What is the SMILES notation for (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane?
The canonical SMILES for (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane is CC1=C([Si](C(C)C)(C(C)C)C(C)C)CCCC1.
What is the InChIKey of (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane?
The InChIKey is NUJXXTFOGUHYHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32Si/c1-12(2)17(13(3)4,14(5)6)16-11-9-8-10-15(16)7/h12-14H,8-11H2,1-7H3.
What are the key properties of (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane?
(2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane has a molecular weight of 252.52 g/mol, XLogP of 6.09, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclohexen-1-yl)-tri(propan-2-yl)silane is sourced from PubChem (CID 134877705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).