About (4-methoxyphenyl)(113C)methyl-trimethylsilane
(4-methoxyphenyl)(113C)methyl-trimethylsilane (PubChem CID 101034579) has the molecular formula C11H18OSi
and a molecular weight of 195.34 g/mol. Its IUPAC name is (4-methoxyphenyl)(113C)methyl-trimethylsilane.
Molecular Properties
| Compound Name | (4-methoxyphenyl)(113C)methyl-trimethylsilane |
| PubChem CID | 101034579 |
| Molecular Formula | C11H18OSi |
| Molecular Weight | 195.34 g/mol |
| Exact Mass | 195.12 |
| IUPAC Name | (4-methoxyphenyl)(113C)methyl-trimethylsilane |
| SMILES | COc1ccc([13CH2][Si](C)(C)C)cc1 |
| InChI | InChI=1S/C11H18OSi/c1-12-11-7-5-10(6-8-11)9-13(2,3)4/h5-8H,9H2,1-4H3/i9+1 |
| InChIKey | YZNOHWUDLGWICS-QBZHADDCSA-N |
| XLogP | 3.12 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 195.34 |
| LogP ≤ 5 | 3.12 |
| 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 (4-methoxyphenyl)(113C)methyl-trimethylsilane?
The IUPAC name of (4-methoxyphenyl)(113C)methyl-trimethylsilane (CID 101034579) is (4-methoxyphenyl)(113C)methyl-trimethylsilane.
What is the SMILES notation for (4-methoxyphenyl)(113C)methyl-trimethylsilane?
The canonical SMILES for (4-methoxyphenyl)(113C)methyl-trimethylsilane is COc1ccc([13CH2][Si](C)(C)C)cc1.
What is the InChIKey of (4-methoxyphenyl)(113C)methyl-trimethylsilane?
The InChIKey is YZNOHWUDLGWICS-QBZHADDCSA-N. The full InChI is InChI=1S/C11H18OSi/c1-12-11-7-5-10(6-8-11)9-13(2,3)4/h5-8H,9H2,1-4H3/i9+1.
What are the key properties of (4-methoxyphenyl)(113C)methyl-trimethylsilane?
(4-methoxyphenyl)(113C)methyl-trimethylsilane has a molecular weight of 195.34 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)(113C)methyl-trimethylsilane is sourced from PubChem (CID 101034579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).