Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate
TL;DR: Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate (CAS 57025-76-0) is a chemical compound with molecular formula C15H9Cl2F3O3 and molecular weight 363.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate
Also Known As: Cp Cap, MC 15608, methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate, LS82.0340, LS 82.0340
| Molecular Formula | C15H9Cl2F3O3 |
|---|---|
| Molecular Weight | 363.99 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.9881 |
| Heavy Atoms | 23 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 57025-76-0 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)Cl |
| InChIKey | FAPHUSSYSVNLNW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate (CAS 57025-76-0), with molecular formula C15H9Cl2F3O3 and molecular weight 363.99 g/mol. IUPAC: methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate.
Chemical Property Profile of Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate
Property Insights of Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate
The XLogP value of 4.2 indicates that Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate has 0 hydrogen bond donor(s) and 6 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-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate?
The CAS number of Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate is 57025-76-0.
What is the molecular formula of Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate?
The molecular formula of Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate is C15H9Cl2F3O3.
What is the molecular weight of Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate?
The molecular weight of Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate is 363.99 g/mol.
Where can I buy Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate?
You can request a quote for Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.