Ethyl 2-(4-vinylphenoxy)isobutyrate
TL;DR: Ethyl 2-(4-vinylphenoxy)isobutyrate (CAS 52179-09-6) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.1256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(4-ethenylphenoxy)-2-methylpropanoate
Also Known As: ethyl2- isobutyrate, Ethyl 2-(4-vinylphenoxy)isobutyrate, ethyl 2-(4-ethenylphenoxy)-2-methylpropanoate, ethyl 2-methyl-2-(4-vinylphenoxy)propanoate, Ethyl 2-(p-vinylphenoxy)-2-methylpropionate
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H18O3 |
| Molecular Weight | 234.1256 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 234.1256 Da |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
| SMILES | CCOC(=O)C(C)(C)OC1=CC=C(C=C1)C=C |
| InChIKey | BYZWKIOOOBNGRO-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-(4-vinylphenoxy)isobutyrate
Property Insights of Ethyl 2-(4-vinylphenoxy)isobutyrate
The XLogP value of 3.5 indicates that Ethyl 2-(4-vinylphenoxy)isobutyrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 2-(4-vinylphenoxy)isobutyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(4-vinylphenoxy)isobutyrate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 2-(4-vinylphenoxy)isobutyrate?
The CAS number of Ethyl 2-(4-vinylphenoxy)isobutyrate is 52179-09-6.
What is the molecular formula of Ethyl 2-(4-vinylphenoxy)isobutyrate?
The molecular formula of Ethyl 2-(4-vinylphenoxy)isobutyrate is C14H18O3.
What is the molecular weight of Ethyl 2-(4-vinylphenoxy)isobutyrate?
The molecular weight of Ethyl 2-(4-vinylphenoxy)isobutyrate is 234.1256 g/mol.
Where can I buy Ethyl 2-(4-vinylphenoxy)isobutyrate?
You can request a quote for Ethyl 2-(4-vinylphenoxy)isobutyrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-(4-vinylphenoxy)isobutyrate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-(4-vinylphenoxy)isobutyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.