Methyl 3-(4-methylphenoxy)propanoate
TL;DR: Methyl 3-(4-methylphenoxy)propanoate (CAS 7497-92-9) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4-methylphenoxy)propanoate
Also Known As: methyl 3-(4-methylphenoxy)propanoate, methyl-3-(4-methylphenoxy)propanoate, methyl 3-(4-methylphenoxy)-propanoate, methyl 3-((4-methylphenyl)oxy)propanoate, RefChem:354698
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 7497-92-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCC(=O)OC |
| InChIKey | BVRVMPKPSNDZLA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 3-(4-methylphenoxy)propanoate (CAS 7497-92-9), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: methyl 3-(4-methylphenoxy)propanoate.
Chemical Property Profile of Methyl 3-(4-methylphenoxy)propanoate
Property Insights of Methyl 3-(4-methylphenoxy)propanoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(4-methylphenoxy)propanoate. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 3-(4-methylphenoxy)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(4-methylphenoxy)propanoate 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 3-(4-methylphenoxy)propanoate?
The CAS number of Methyl 3-(4-methylphenoxy)propanoate is 7497-92-9.
What is the molecular formula of Methyl 3-(4-methylphenoxy)propanoate?
The molecular formula of Methyl 3-(4-methylphenoxy)propanoate is C11H14O3.
What is the molecular weight of Methyl 3-(4-methylphenoxy)propanoate?
The molecular weight of Methyl 3-(4-methylphenoxy)propanoate is 194.09 g/mol.
Where can I buy Methyl 3-(4-methylphenoxy)propanoate?
You can request a quote for Methyl 3-(4-methylphenoxy)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(4-methylphenoxy)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(4-methylphenoxy)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.