About [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane
[(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane (PubChem CID 88610405) has the molecular formula C16H33FOSi
and a molecular weight of 288.52 g/mol. Its IUPAC name is [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane.
Molecular Properties
| Compound Name | [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane |
| PubChem CID | 88610405 |
| Molecular Formula | C16H33FOSi |
| Molecular Weight | 288.52 g/mol |
| Exact Mass | 288.23 |
| IUPAC Name | [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane |
| SMILES | CCCC(C)(C)[Si](C)(C)OC[C@@H](/C=C(/C)F)C(C)C |
| InChI | InChI=1S/C16H33FOSi/c1-9-10-16(5,6)19(7,8)18-12-15(13(2)3)11-14(4)17/h11,13,15H,9-10,12H2,1-8H3/b14-11-/t15-/m1/s1 |
| InChIKey | UVGRAJGEFPLFMO-QKXCFHHRSA-N |
| XLogP | 5.93 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 288.52 |
| LogP ≤ 5 | 5.93 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane?
The IUPAC name of [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane (CID 88610405) is [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane.
What is the SMILES notation for [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane?
The canonical SMILES for [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane is CCCC(C)(C)[Si](C)(C)OC[C@@H](/C=C(/C)F)C(C)C.
What is the InChIKey of [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane?
The InChIKey is UVGRAJGEFPLFMO-QKXCFHHRSA-N. The full InChI is InChI=1S/C16H33FOSi/c1-9-10-16(5,6)19(7,8)18-12-15(13(2)3)11-14(4)17/h11,13,15H,9-10,12H2,1-8H3/b14-11-/t15-/m1/s1.
What are the key properties of [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane?
[(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane has a molecular weight of 288.52 g/mol, XLogP of 5.93, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z,2R)-4-fluoro-2-propan-2-ylpent-3-enoxy]-dimethyl-(2-methylpentan-2-yl)silane is sourced from PubChem (CID 88610405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).