4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate
TL;DR: 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate (CAS 306279-47-0) is a chemical compound with molecular formula C16H14Cl2O3 and molecular weight 324.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chloro-3-methylphenyl) 2-(4-chloro-3-methylphenoxy)acetate
Also Known As: BAS 00581154, 4-chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate, 4-chloro-3-methylphenyl 2-(4-chloro-3-methylphenoxy)acetate, (4-chloro-3-methylphenyl) 2-(4-chloro-3-methylphenoxy)acetate, (4-Chloro-3-methyl-phenoxy)-acetic acid 4-chloro-3-methyl-phenyl ester
| Molecular Formula | C16H14Cl2O3 |
|---|---|
| Molecular Weight | 324.03 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.032 |
| Heavy Atoms | 21 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 306279-47-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC(=O)OC2=CC(=C(C=C2)Cl)C)Cl |
| InChIKey | ZVRIALXQXCSUBH-UHFFFAOYSA-N |
Product Overview
4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate (CAS 306279-47-0), with molecular formula C16H14Cl2O3 and molecular weight 324.03 g/mol. IUPAC: (4-chloro-3-methylphenyl) 2-(4-chloro-3-methylphenoxy)acetate.
Chemical Property Profile of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate
Property Insights of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate
The XLogP value of 5.4 indicates that 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)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, 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate?
The CAS number of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate is 306279-47-0.
What is the molecular formula of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate?
The molecular formula of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate is C16H14Cl2O3.
What is the molecular weight of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate?
The molecular weight of 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate is 324.03 g/mol.
Where can I buy 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate?
You can request a quote for 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3-methylphenyl (4-chloro-3-methylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.