Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester
TL;DR: Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester (CAS 62095-41-4) 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.
(4-chlorophenyl) 2-(2-methylphenoxy)acetate
Also Known As: 4-chlorophenyl 2-(2-methylphenoxy)acetate, 4-chlorophenyl (2-methylphenoxy)acetate, (4-chlorophenyl) 2-(2-methylphenoxy)acetate, Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester
| 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 | 563.8583 |
Chemical Identifiers
| CAS Number | 62095-41-4 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(=O)OC2=CC=C(C=C2)Cl |
Product Overview
Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester (CAS 62095-41-4), with molecular formula C15H13ClO3 and molecular weight 276.06 g/mol. IUPAC: (4-chlorophenyl) 2-(2-methylphenoxy)acetate.
Chemical Property Profile of Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester
Property Insights of Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester
The XLogP value of 3.63282 indicates that Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester 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 Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester?
The CAS number of Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester is 62095-41-4.
What is the molecular formula of Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester?
The molecular formula of Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester is C15H13ClO3.
What is the molecular weight of Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester?
The molecular weight of Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester is 276.06 g/mol.
Where can I buy Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester?
You can request a quote for Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (2-methylphenoxy)-, 4-chlorophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.