About tripropoxysilylmethyl 2-methylprop-2-enoate
tripropoxysilylmethyl 2-methylprop-2-enoate (PubChem CID 22266632) has the molecular formula C14H28O5Si
and a molecular weight of 304.46 g/mol. Its IUPAC name is tripropoxysilylmethyl 2-methylprop-2-enoate.
Molecular Properties
| Compound Name | tripropoxysilylmethyl 2-methylprop-2-enoate |
| PubChem CID | 22266632 |
| Molecular Formula | C14H28O5Si |
| Molecular Weight | 304.46 g/mol |
| Exact Mass | 304.17 |
| IUPAC Name | tripropoxysilylmethyl 2-methylprop-2-enoate |
| SMILES | C=C(C)C(=O)OC[Si](OCCC)(OCCC)OCCC |
| InChI | InChI=1S/C14H28O5Si/c1-6-9-17-20(18-10-7-2,19-11-8-3)12-16-14(15)13(4)5/h4,6-12H2,1-3,5H3 |
| InChIKey | QYTRLLRHSKCMOP-UHFFFAOYSA-N |
| XLogP | 2.86 |
| TPSA | 53.99 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 304.46 |
| LogP ≤ 5 | 2.86 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'} |
|---|
Analyze tripropoxysilylmethyl 2-methylprop-2-enoate 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 tripropoxysilylmethyl 2-methylprop-2-enoate?
The IUPAC name of tripropoxysilylmethyl 2-methylprop-2-enoate (CID 22266632) is tripropoxysilylmethyl 2-methylprop-2-enoate.
What is the SMILES notation for tripropoxysilylmethyl 2-methylprop-2-enoate?
The canonical SMILES for tripropoxysilylmethyl 2-methylprop-2-enoate is C=C(C)C(=O)OC[Si](OCCC)(OCCC)OCCC.
What is the InChIKey of tripropoxysilylmethyl 2-methylprop-2-enoate?
The InChIKey is QYTRLLRHSKCMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O5Si/c1-6-9-17-20(18-10-7-2,19-11-8-3)12-16-14(15)13(4)5/h4,6-12H2,1-3,5H3.
What are the key properties of tripropoxysilylmethyl 2-methylprop-2-enoate?
tripropoxysilylmethyl 2-methylprop-2-enoate has a molecular weight of 304.46 g/mol, XLogP of 2.86, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tripropoxysilylmethyl 2-methylprop-2-enoate is sourced from PubChem (CID 22266632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).