Ethyl (4-chlorophenyl)acetate
TL;DR: Ethyl (4-chlorophenyl)acetate (CAS 14062-24-9) is a chemical compound with molecular formula C10H11ClO2 and molecular weight 198.04475 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(4-chlorophenyl)acetate
Also Known As: Ethyl 4-chlorophenylacetate, Ethyl (4-chlorophenyl)acetate, ethyl 2-(4-chlorophenyl)acetate, Pratensein, Benzeneacetic acid, 4-chloro-, ethyl ester
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H11ClO2 |
| Molecular Weight | 198.04475 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.04475 Da |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
| SMILES | CCOC(=O)CC1=CC=C(C=C1)Cl |
| InChIKey | UTWBWFXECVFDPZ-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl (4-chlorophenyl)acetate
Property Insights of Ethyl (4-chlorophenyl)acetate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (4-chlorophenyl)acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl (4-chlorophenyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (4-chlorophenyl)acetate has 0 hydrogen bond donor(s) and 2 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-chlorophenyl)acetate?
The CAS number of Ethyl (4-chlorophenyl)acetate is 14062-24-9.
What is the molecular formula of Ethyl (4-chlorophenyl)acetate?
The molecular formula of Ethyl (4-chlorophenyl)acetate is C10H11ClO2.
What is the molecular weight of Ethyl (4-chlorophenyl)acetate?
The molecular weight of Ethyl (4-chlorophenyl)acetate is 198.04475 g/mol.
Where can I buy Ethyl (4-chlorophenyl)acetate?
You can request a quote for Ethyl (4-chlorophenyl)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl (4-chlorophenyl)acetate?
Yes, CoreyChem provides custom synthesis services for Ethyl (4-chlorophenyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.