Phenyl (4-chlorophenoxy)acetate
TL;DR: Phenyl (4-chlorophenoxy)acetate (CAS 62095-51-6) is a chemical compound with molecular formula C14H11ClO3 and molecular weight 262.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 2-(4-chlorophenoxy)acetate
Also Known As: phenyl (4-chlorophenoxy)acetate, phenyl 2-(4-chlorophenoxy)acetate, TimTec1_002916, Acetic acid, (4-chlorophenoxy)-, phenyl ester, AN-329/40887288
| Molecular Formula | C14H11ClO3 |
|---|---|
| Molecular Weight | 262.04 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.03967 |
| Heavy Atoms | 18 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 62095-51-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)COC2=CC=C(C=C2)Cl |
| InChIKey | NUNLXXARLCXOPW-UHFFFAOYSA-N |
Product Overview
Phenyl (4-chlorophenoxy)acetate (CAS 62095-51-6), with molecular formula C14H11ClO3 and molecular weight 262.04 g/mol. IUPAC: phenyl 2-(4-chlorophenoxy)acetate.
Chemical Property Profile of Phenyl (4-chlorophenoxy)acetate
Property Insights of Phenyl (4-chlorophenoxy)acetate
The XLogP value of 4.0 indicates that Phenyl (4-chlorophenoxy)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, Phenyl (4-chlorophenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl (4-chlorophenoxy)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 Phenyl (4-chlorophenoxy)acetate?
The CAS number of Phenyl (4-chlorophenoxy)acetate is 62095-51-6.
What is the molecular formula of Phenyl (4-chlorophenoxy)acetate?
The molecular formula of Phenyl (4-chlorophenoxy)acetate is C14H11ClO3.
What is the molecular weight of Phenyl (4-chlorophenoxy)acetate?
The molecular weight of Phenyl (4-chlorophenoxy)acetate is 262.04 g/mol.
Where can I buy Phenyl (4-chlorophenoxy)acetate?
You can request a quote for Phenyl (4-chlorophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl (4-chlorophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl (4-chlorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.