Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate
TL;DR: Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate (CAS 52011-25-3) is a chemical compound with molecular formula C12H15ClO3 and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate
Also Known As: ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate, ethyl (4-chloro-2,5-dimethylphenoxy)acetate, Ethyl 2-(4-chloro-2,5-dimethyl-phenoxy)acetate
| Molecular Formula | C12H15ClO3 |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.07097 |
| Heavy Atoms | 16 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 52011-25-3 |
|---|---|
| SMILES | CCOC(=O)COC1=C(C=C(C(=C1)C)Cl)C |
| InChIKey | DCRQEAQVBBPELU-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate (CAS 52011-25-3), with molecular formula C12H15ClO3 and molecular weight 242.07 g/mol. IUPAC: ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate.
Chemical Property Profile of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate
Property Insights of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate
The XLogP value of 3.5 indicates that Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate 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-chloro-2,5-dimethylphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate 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
Frequently Asked Questions
What is the CAS number of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate?
The CAS number of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate is 52011-25-3.
What is the molecular formula of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate?
The molecular formula of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate is C12H15ClO3.
What is the molecular weight of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate?
The molecular weight of Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate is 242.07 g/mol.
Where can I buy Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate?
You can request a quote for Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(4-chloro-2,5-dimethylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.