About (1-methoxy-2-methylprop-1-enyl) trimethyl silicate
(1-methoxy-2-methylprop-1-enyl) trimethyl silicate (PubChem CID 21245406) has the molecular formula C8H18O5Si
and a molecular weight of 222.31 g/mol. Its IUPAC name is (1-methoxy-2-methylprop-1-enyl) trimethyl silicate.
Molecular Properties
| Compound Name | (1-methoxy-2-methylprop-1-enyl) trimethyl silicate |
| PubChem CID | 21245406 |
| Molecular Formula | C8H18O5Si |
| Molecular Weight | 222.31 g/mol |
| Exact Mass | 222.09 |
| IUPAC Name | (1-methoxy-2-methylprop-1-enyl) trimethyl silicate |
| SMILES | COC(O[Si](OC)(OC)OC)=C(C)C |
| InChI | InChI=1S/C8H18O5Si/c1-7(2)8(9-3)13-14(10-4,11-5)12-6/h1-6H3 |
| InChIKey | VMNIMNVCKLIDNL-UHFFFAOYSA-N |
| XLogP | 1.28 |
| TPSA | 46.15 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 222.31 |
| LogP ≤ 5 | 1.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze (1-methoxy-2-methylprop-1-enyl) trimethyl silicate with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of (1-methoxy-2-methylprop-1-enyl) trimethyl silicate?
The IUPAC name of (1-methoxy-2-methylprop-1-enyl) trimethyl silicate (CID 21245406) is (1-methoxy-2-methylprop-1-enyl) trimethyl silicate.
What is the SMILES notation for (1-methoxy-2-methylprop-1-enyl) trimethyl silicate?
The canonical SMILES for (1-methoxy-2-methylprop-1-enyl) trimethyl silicate is COC(O[Si](OC)(OC)OC)=C(C)C.
What is the InChIKey of (1-methoxy-2-methylprop-1-enyl) trimethyl silicate?
The InChIKey is VMNIMNVCKLIDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O5Si/c1-7(2)8(9-3)13-14(10-4,11-5)12-6/h1-6H3.
What are the key properties of (1-methoxy-2-methylprop-1-enyl) trimethyl silicate?
(1-methoxy-2-methylprop-1-enyl) trimethyl silicate has a molecular weight of 222.31 g/mol, XLogP of 1.28, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-2-methylprop-1-enyl) trimethyl silicate is sourced from PubChem (CID 21245406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).