About trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane
trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane (PubChem CID 15750658) has the molecular formula C14H22O2Si
and a molecular weight of 250.41 g/mol. Its IUPAC name is trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane.
Molecular Properties
| Compound Name | trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane |
| PubChem CID | 15750658 |
| Molecular Formula | C14H22O2Si |
| Molecular Weight | 250.41 g/mol |
| Exact Mass | 250.14 |
| IUPAC Name | trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane |
| SMILES | CC(C)=C(Oc1ccc(C)cc1)O[Si](C)(C)C |
| InChI | InChI=1S/C14H22O2Si/c1-11(2)14(16-17(4,5)6)15-13-9-7-12(3)8-10-13/h7-10H,1-6H3 |
| InChIKey | FSYVDJWSHGBFMX-UHFFFAOYSA-N |
| XLogP | 4.48 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 250.41 |
| LogP ≤ 5 | 4.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane?
The IUPAC name of trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane (CID 15750658) is trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane.
What is the SMILES notation for trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane?
The canonical SMILES for trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane is CC(C)=C(Oc1ccc(C)cc1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane?
The InChIKey is FSYVDJWSHGBFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2Si/c1-11(2)14(16-17(4,5)6)15-13-9-7-12(3)8-10-13/h7-10H,1-6H3.
What are the key properties of trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane?
trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane has a molecular weight of 250.41 g/mol, XLogP of 4.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-methyl-1-(4-methylphenoxy)prop-1-enoxy]silane is sourced from PubChem (CID 15750658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).