About [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane
[(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane (PubChem CID 134949359) has the molecular formula C19H32OSi
and a molecular weight of 304.55 g/mol. Its IUPAC name is [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane.
Molecular Properties
| Compound Name | [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane |
| PubChem CID | 134949359 |
| Molecular Formula | C19H32OSi |
| Molecular Weight | 304.55 g/mol |
| Exact Mass | 304.22 |
| IUPAC Name | [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane |
| SMILES | COc1ccc(/C=C\C[Si](C(C)C)(C(C)C)C(C)C)cc1 |
| InChI | InChI=1S/C19H32OSi/c1-15(2)21(16(3)4,17(5)6)14-8-9-18-10-12-19(20-7)13-11-18/h8-13,15-17H,14H2,1-7H3/b9-8- |
| InChIKey | DMJKMRVJJHSJNA-HJWRWDBZSA-N |
| XLogP | 6.39 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 304.55 |
| LogP ≤ 5 | 6.39 |
| 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)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane?
The IUPAC name of [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane (CID 134949359) is [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane.
What is the SMILES notation for [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane?
The canonical SMILES for [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane is COc1ccc(/C=C\C[Si](C(C)C)(C(C)C)C(C)C)cc1.
What is the InChIKey of [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane?
The InChIKey is DMJKMRVJJHSJNA-HJWRWDBZSA-N. The full InChI is InChI=1S/C19H32OSi/c1-15(2)21(16(3)4,17(5)6)14-8-9-18-10-12-19(20-7)13-11-18/h8-13,15-17H,14H2,1-7H3/b9-8-.
What are the key properties of [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane?
[(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane has a molecular weight of 304.55 g/mol, XLogP of 6.39, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-(4-methoxyphenyl)prop-2-enyl]-tri(propan-2-yl)silane is sourced from PubChem (CID 134949359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).