Methyl 2-(4-chlorophenoxy)-2-methylpropanoate
TL;DR: Methyl 2-(4-chlorophenoxy)-2-methylpropanoate (CAS 55162-41-9) is a chemical compound with molecular formula C11H13ClO3 and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-chlorophenoxy)-2-methylpropanoate
Also Known As: Methyl 2-(4-chlorophenoxy)-2-methylpropanoate, CPIB methyl ester, Clofibrate Methyl Ester, clofibric acid methyl ester, Methyl 2-(4-Chlorophenoxy)-2-methylpropionate
| Molecular Formula | C11H13ClO3 |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.05533 |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 55162-41-9 |
|---|---|
| SMILES | CC(C)(C(=O)OC)OC1=CC=C(C=C1)Cl |
| InChIKey | UXIVINXAZVEIMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-(4-chlorophenoxy)-2-methylpropanoate (CAS 55162-41-9), with molecular formula C11H13ClO3 and molecular weight 228.06 g/mol. IUPAC: methyl 2-(4-chlorophenoxy)-2-methylpropanoate.
Chemical Property Profile of Methyl 2-(4-chlorophenoxy)-2-methylpropanoate
Property Insights of Methyl 2-(4-chlorophenoxy)-2-methylpropanoate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(4-chlorophenoxy)-2-methylpropanoate. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 2-(4-chlorophenoxy)-2-methylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(4-chlorophenoxy)-2-methylpropanoate 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 Methyl 2-(4-chlorophenoxy)-2-methylpropanoate?
The CAS number of Methyl 2-(4-chlorophenoxy)-2-methylpropanoate is 55162-41-9.
What is the molecular formula of Methyl 2-(4-chlorophenoxy)-2-methylpropanoate?
The molecular formula of Methyl 2-(4-chlorophenoxy)-2-methylpropanoate is C11H13ClO3.
What is the molecular weight of Methyl 2-(4-chlorophenoxy)-2-methylpropanoate?
The molecular weight of Methyl 2-(4-chlorophenoxy)-2-methylpropanoate is 228.06 g/mol.
Where can I buy Methyl 2-(4-chlorophenoxy)-2-methylpropanoate?
You can request a quote for Methyl 2-(4-chlorophenoxy)-2-methylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(4-chlorophenoxy)-2-methylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(4-chlorophenoxy)-2-methylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.