4-Methoxynaphthalene-1-carboxylate
TL;DR: 4-Methoxynaphthalene-1-carboxylate (CAS 13041-62-8) is a chemical compound with molecular formula C12H9O3- and molecular weight 201.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxynaphthalene-1-carboxylate
Also Known As: 4-methoxynaphthalene-1-carboxylate, 4-methoxy-1-naphthoic acid, I14-11421
| Molecular Formula | C12H9O3- |
|---|---|
| Molecular Weight | 201.06 g/mol |
| LogP | 1.2119 |
| Topological Polar Surface Area | 49.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.05518 |
| Heavy Atoms | 15 |
| Complexity | 517.2562 |
Chemical Identifiers
| CAS Number | 13041-62-8 |
|---|---|
| SMILES | COC1=CC=C(C2=CC=CC=C21)C(=O)[O-] |
Product Overview
4-Methoxynaphthalene-1-carboxylate (CAS 13041-62-8), with molecular formula C12H9O3- and molecular weight 201.06 g/mol. IUPAC: 4-methoxynaphthalene-1-carboxylate.
Chemical Property Profile of 4-Methoxynaphthalene-1-carboxylate
Property Insights of 4-Methoxynaphthalene-1-carboxylate
The XLogP value of 1.2119 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxynaphthalene-1-carboxylate. With a topological polar surface area (TPSA) of 49.36 Ų, 4-Methoxynaphthalene-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxynaphthalene-1-carboxylate 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 4-Methoxynaphthalene-1-carboxylate?
The CAS number of 4-Methoxynaphthalene-1-carboxylate is 13041-62-8.
What is the molecular formula of 4-Methoxynaphthalene-1-carboxylate?
The molecular formula of 4-Methoxynaphthalene-1-carboxylate is C12H9O3-.
What is the molecular weight of 4-Methoxynaphthalene-1-carboxylate?
The molecular weight of 4-Methoxynaphthalene-1-carboxylate is 201.06 g/mol.
Where can I buy 4-Methoxynaphthalene-1-carboxylate?
You can request a quote for 4-Methoxynaphthalene-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxynaphthalene-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxynaphthalene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.