5,6-Dimethoxy-2-naphthoic acid
TL;DR: 5,6-Dimethoxy-2-naphthoic acid (CAS 126674-76-8) is a chemical compound with molecular formula C13H12O4 and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethoxynaphthalene-2-carboxylic acid
Also Known As: 5,6-Dimethoxy-2-naphthoic acid, 5,6-dimethoxynaphthalene-2-carboxylic acid, NCI60_023218, 5,6-dimethoxy-2-Naphthalenecarboxylic acid, J2.301.689C
| Molecular Formula | C13H12O4 |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.07356 |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 126674-76-8 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C=C(C=C2)C(=O)O)OC |
| InChIKey | RHWBIJFJDHSLFI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,6-Dimethoxy-2-naphthoic acid (CAS 126674-76-8), with molecular formula C13H12O4 and molecular weight 232.07 g/mol. IUPAC: 5,6-dimethoxynaphthalene-2-carboxylic acid.
Chemical Property Profile of 5,6-Dimethoxy-2-naphthoic acid
Property Insights of 5,6-Dimethoxy-2-naphthoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-Dimethoxy-2-naphthoic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 5,6-Dimethoxy-2-naphthoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Dimethoxy-2-naphthoic acid has 1 hydrogen bond donor(s) and 4 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 5,6-Dimethoxy-2-naphthoic acid?
The CAS number of 5,6-Dimethoxy-2-naphthoic acid is 126674-76-8.
What is the molecular formula of 5,6-Dimethoxy-2-naphthoic acid?
The molecular formula of 5,6-Dimethoxy-2-naphthoic acid is C13H12O4.
What is the molecular weight of 5,6-Dimethoxy-2-naphthoic acid?
The molecular weight of 5,6-Dimethoxy-2-naphthoic acid is 232.07 g/mol.
Where can I buy 5,6-Dimethoxy-2-naphthoic acid?
You can request a quote for 5,6-Dimethoxy-2-naphthoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dimethoxy-2-naphthoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dimethoxy-2-naphthoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.