Cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol
C13H26OSi — CID 15263617
Data last refreshed: (MolForge compound catalog, from PubChem)
About Cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol
Cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol (PubChem CID 15263617) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol.
Molecular Properties
| Compound Name | Cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol |
|---|---|
| PubChem CID | 15263617 |
| Molecular Formula | C13H26OSi |
| Molecular Weight | 226.44 g/mol |
| Exact Mass | 226.18 |
| IUPAC Name | cis-(1S,2R)-2-[2-(trimethylsilylmethyl)prop-2-enyl]cyclohexan-1-ol |
| SMILES | C=C(C[C@H]1CCCC[C@@H]1O)C[Si](C)(C)C |
| InChI | InChI=1S/C13H26OSi/c1-11(10-15(2,3)4)9-12-7-5-6-8-13(12)14/h12-14H,1,5-10H2,2-4H3/t12-,13+/m1/s1 |
| InChIKey | MQMBAMDSGJLLRB-OLZOCXBDSA-N |
| XLogP | 3.82 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 226.44 |
| LogP ≤ 5 | 3.82 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
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Sources
- PubChem CID 15263617 — identifiers, structure, computed properties (public domain)
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