Ethyl 6-methoxy-2-naphthoate
TL;DR: Ethyl 6-methoxy-2-naphthoate (CAS 104121-58-6) is a chemical compound with molecular formula C14H14O3 and molecular weight 230.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methoxynaphthalene-2-carboxylate
Also Known As: Ethyl 6-methoxy-2-naphthoate, Naproxen Impurity 59, Nabumetone Impurity 28, ethyl 6-methoxynaphthalene-2-carboxylate, Ethyl 6-methoxy 2-Naphthoate
| Molecular Formula | C14H14O3 |
|---|---|
| Molecular Weight | 230.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.0943 |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 104121-58-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC |
| InChIKey | VSRGZETWBNHFSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 6-methoxy-2-naphthoate (CAS 104121-58-6), with molecular formula C14H14O3 and molecular weight 230.09 g/mol. IUPAC: ethyl 6-methoxynaphthalene-2-carboxylate.
Chemical Property Profile of Ethyl 6-methoxy-2-naphthoate
Property Insights of Ethyl 6-methoxy-2-naphthoate
The XLogP value of 3.4 indicates that Ethyl 6-methoxy-2-naphthoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 6-methoxy-2-naphthoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-methoxy-2-naphthoate 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 Ethyl 6-methoxy-2-naphthoate?
The CAS number of Ethyl 6-methoxy-2-naphthoate is 104121-58-6.
What is the molecular formula of Ethyl 6-methoxy-2-naphthoate?
The molecular formula of Ethyl 6-methoxy-2-naphthoate is C14H14O3.
What is the molecular weight of Ethyl 6-methoxy-2-naphthoate?
The molecular weight of Ethyl 6-methoxy-2-naphthoate is 230.09 g/mol.
Where can I buy Ethyl 6-methoxy-2-naphthoate?
You can request a quote for Ethyl 6-methoxy-2-naphthoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-methoxy-2-naphthoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-methoxy-2-naphthoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.