Methyl 1-methoxy-2-naphthoate
TL;DR: Methyl 1-methoxy-2-naphthoate (CAS 6039-59-4) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methoxynaphthalene-2-carboxylate
Also Known As: Methyl 1-methoxy-2-naphthoate, Methyl 1-methoxynaphthalene-2-carboxylate, 1-Methoxy-2-naphthoic acid methyl ester, METHYL1-METHOXY-2-NAPHTHOATE, Methyl 1-methoxy-2-naphthoate, 98%
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 2.635 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 531.6888 |
Chemical Identifiers
| CAS Number | 6039-59-4 |
|---|---|
| SMILES | COC1=C(C=CC2=CC=CC=C21)C(=O)OC |
Product Overview
Methyl 1-methoxy-2-naphthoate (CAS 6039-59-4), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: methyl 1-methoxynaphthalene-2-carboxylate.
Chemical Property Profile of Methyl 1-methoxy-2-naphthoate
Property Insights of Methyl 1-methoxy-2-naphthoate
The XLogP value of 2.635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-methoxy-2-naphthoate. With a topological polar surface area (TPSA) of 35.53 Ų, Methyl 1-methoxy-2-naphthoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-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 Methyl 1-methoxy-2-naphthoate?
The CAS number of Methyl 1-methoxy-2-naphthoate is 6039-59-4.
What is the molecular formula of Methyl 1-methoxy-2-naphthoate?
The molecular formula of Methyl 1-methoxy-2-naphthoate is C13H12O3.
What is the molecular weight of Methyl 1-methoxy-2-naphthoate?
The molecular weight of Methyl 1-methoxy-2-naphthoate is 216.08 g/mol.
Where can I buy Methyl 1-methoxy-2-naphthoate?
You can request a quote for Methyl 1-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 Methyl 1-methoxy-2-naphthoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-methoxy-2-naphthoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.