2-Methylphenyl (4-chloro-2-methylphenoxy)acetate
TL;DR: 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate (CAS 433261-94-0) is a chemical compound with molecular formula C16H15ClO3 and molecular weight 290.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylphenyl) 2-(4-chloro-2-methylphenoxy)acetate
Also Known As: 2-methylphenyl (4-chloro-2-methylphenoxy)acetate, 2-methylphenyl 2-(4-chloro-2-methylphenoxy)acetate, (2-methylphenyl) 2-(4-chloro-2-methylphenoxy)acetate, AN-329/40887316
| Molecular Formula | C16H15ClO3 |
|---|---|
| Molecular Weight | 290.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.07098 |
| Heavy Atoms | 20 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 433261-94-0 |
|---|---|
| SMILES | CC1=CC=CC=C1OC(=O)COC2=C(C=C(C=C2)Cl)C |
| InChIKey | PSDRESCCXWVBMC-UHFFFAOYSA-N |
Product Overview
2-Methylphenyl (4-chloro-2-methylphenoxy)acetate (CAS 433261-94-0), with molecular formula C16H15ClO3 and molecular weight 290.07 g/mol. IUPAC: (2-methylphenyl) 2-(4-chloro-2-methylphenoxy)acetate.
Chemical Property Profile of 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate
Property Insights of 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate
The XLogP value of 4.7 indicates that 2-Methylphenyl (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 35.5 Ų, 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylphenyl (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 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate?
The CAS number of 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate is 433261-94-0.
What is the molecular formula of 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate?
The molecular formula of 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate is C16H15ClO3.
What is the molecular weight of 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate?
The molecular weight of 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate is 290.07 g/mol.
Where can I buy 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate?
You can request a quote for 2-Methylphenyl (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 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylphenyl (4-chloro-2-methylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.