Phenyl (4-chloro-2-methylphenoxy)acetate
TL;DR: Phenyl (4-chloro-2-methylphenoxy)acetate (CAS 67829-82-7) is a chemical compound with molecular formula C15H13ClO3 and molecular weight 276.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 2-(4-chloro-2-methylphenoxy)acetate
Also Known As: phenyl (4-chloro-2-methylphenoxy)acetate, phenyl 2-(4-chloro-2-methylphenoxy)acetate
| Molecular Formula | C15H13ClO3 |
|---|---|
| Molecular Weight | 276.06 g/mol |
| LogP | 3.63282 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.05533 |
| Heavy Atoms | 19 |
| Complexity | 566.8583 |
Chemical Identifiers
| CAS Number | 67829-82-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCC(=O)OC2=CC=CC=C2 |
Product Overview
Phenyl (4-chloro-2-methylphenoxy)acetate (CAS 67829-82-7), with molecular formula C15H13ClO3 and molecular weight 276.06 g/mol. IUPAC: phenyl 2-(4-chloro-2-methylphenoxy)acetate.
Chemical Property Profile of Phenyl (4-chloro-2-methylphenoxy)acetate
Property Insights of Phenyl (4-chloro-2-methylphenoxy)acetate
The XLogP value of 3.63282 indicates that Phenyl (4-chloro-2-methylphenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Phenyl (4-chloro-2-methylphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl (4-chloro-2-methylphenoxy)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-chloro-2-methylphenoxy)acetate?
The CAS number of Phenyl (4-chloro-2-methylphenoxy)acetate is 67829-82-7.
What is the molecular formula of Phenyl (4-chloro-2-methylphenoxy)acetate?
The molecular formula of Phenyl (4-chloro-2-methylphenoxy)acetate is C15H13ClO3.
What is the molecular weight of Phenyl (4-chloro-2-methylphenoxy)acetate?
The molecular weight of Phenyl (4-chloro-2-methylphenoxy)acetate is 276.06 g/mol.
Where can I buy Phenyl (4-chloro-2-methylphenoxy)acetate?
You can request a quote for Phenyl (4-chloro-2-methylphenoxy)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-chloro-2-methylphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl (4-chloro-2-methylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.