Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate
TL;DR: Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate (CAS 23673-53-2) is a chemical compound with molecular formula C15H16O5 and molecular weight 276.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5,6,7-trimethoxynaphthalene-2-carboxylate
Also Known As: methyl 5,6,7-trimethoxynaphthalene-2-carboxylate, Methyl 5,6,7-trimethoxy-2-naphthoate #, 2-Naphthoic acid, 5,6,7-trimethoxy-, methyl ester, 2-Naphthalenecarboxylic acid, 5,6,7-trimethoxy-, methyl ester, 5,6,7-Trimethoxy-2-naphthalenecarboxylicacidmethylester
| Molecular Formula | C15H16O5 |
|---|---|
| Molecular Weight | 276.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 276.09976 |
| Heavy Atoms | 20 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 23673-53-2 |
|---|---|
| SMILES | COC1=C(C(=C2C=CC(=CC2=C1)C(=O)OC)OC)OC |
| InChIKey | POZJFDUKFIWVOQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate (CAS 23673-53-2), with molecular formula C15H16O5 and molecular weight 276.10 g/mol. IUPAC: methyl 5,6,7-trimethoxynaphthalene-2-carboxylate.
Chemical Property Profile of Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate
Property Insights of Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate. With a topological polar surface area (TPSA) of 54.0 Ų, Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate has 0 hydrogen bond donor(s) and 5 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 5,6,7-trimethoxynaphthalene-2-carboxylate?
The CAS number of Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate is 23673-53-2.
What is the molecular formula of Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate?
The molecular formula of Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate is C15H16O5.
What is the molecular weight of Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate?
The molecular weight of Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate is 276.10 g/mol.
Where can I buy Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate?
You can request a quote for Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5,6,7-trimethoxynaphthalene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.