Ethyl 4-acetylphenylacetate
TL;DR: Ethyl 4-acetylphenylacetate (CAS 1528-42-3) is a chemical compound with molecular formula C12H14O3 and molecular weight 206.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(4-acetylphenyl)acetate
Also Known As: ethyl 2-(4-acetylphenyl)acetate, Ethyl 4-acetylphenylacetate, ethyl (4-acetylphenyl)acetate, Ethyl4-acetylphenylacetate, ethyl-(4-acetylphenyl)acetat
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H14O3 |
| Molecular Weight | 206.0943 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 206.0943 Da |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
| SMILES | CCOC(=O)CC1=CC=C(C=C1)C(=O)C |
| InChIKey | UYKWAZSTKGYKOG-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 4-acetylphenylacetate
Property Insights of Ethyl 4-acetylphenylacetate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-acetylphenylacetate. With a topological polar surface area (TPSA) of 43.4 Ų, Ethyl 4-acetylphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-acetylphenylacetate 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 4-acetylphenylacetate?
The CAS number of Ethyl 4-acetylphenylacetate is 1528-42-3.
What is the molecular formula of Ethyl 4-acetylphenylacetate?
The molecular formula of Ethyl 4-acetylphenylacetate is C12H14O3.
What is the molecular weight of Ethyl 4-acetylphenylacetate?
The molecular weight of Ethyl 4-acetylphenylacetate is 206.0943 g/mol.
Where can I buy Ethyl 4-acetylphenylacetate?
You can request a quote for Ethyl 4-acetylphenylacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 4-acetylphenylacetate?
Yes, CoreyChem provides custom synthesis services for Ethyl 4-acetylphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.