Methyl 2-(4-methylphenoxy)benzoate
TL;DR: Methyl 2-(4-methylphenoxy)benzoate (CAS 21905-72-6) is a chemical compound with molecular formula C15H14O3 and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-methylphenoxy)benzoate
Also Known As: Methyl 2-(4-methylphenoxy)benzoate, 2- benzoicacidmethylester, o-(p-Tolyloxy)benzoic Acid Methyl Ester, Methyl 2-(p-tolyloxy)benzoate, 2-(4-Methylphenoxy)benzoic acid methyl ester
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.0943 |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 21905-72-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=CC=CC=C2C(=O)OC |
| InChIKey | YUVWKZDKWYOCFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-(4-methylphenoxy)benzoate (CAS 21905-72-6), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: methyl 2-(4-methylphenoxy)benzoate.
Chemical Property Profile of Methyl 2-(4-methylphenoxy)benzoate
Property Insights of Methyl 2-(4-methylphenoxy)benzoate
The XLogP value of 4.0 indicates that Methyl 2-(4-methylphenoxy)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 2-(4-methylphenoxy)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(4-methylphenoxy)benzoate 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 Methyl 2-(4-methylphenoxy)benzoate?
The CAS number of Methyl 2-(4-methylphenoxy)benzoate is 21905-72-6.
What is the molecular formula of Methyl 2-(4-methylphenoxy)benzoate?
The molecular formula of Methyl 2-(4-methylphenoxy)benzoate is C15H14O3.
What is the molecular weight of Methyl 2-(4-methylphenoxy)benzoate?
The molecular weight of Methyl 2-(4-methylphenoxy)benzoate is 242.09 g/mol.
Where can I buy Methyl 2-(4-methylphenoxy)benzoate?
You can request a quote for Methyl 2-(4-methylphenoxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(4-methylphenoxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(4-methylphenoxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.