Methyl 8-methoxynaphthalene-1-carboxylate
TL;DR: Methyl 8-methoxynaphthalene-1-carboxylate (CAS 6039-60-7) 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 8-methoxynaphthalene-1-carboxylate
Also Known As: Methyl 8-methoxy-1-naphthoate, methyl 8-methoxynaphthalene-1-carboxylate, Methyl 1-naphthoate, 8-methoxy-, Methyl 8-methoxy-1-naphthoate #, Methyl 8-methoxy-1-naphthalenecarboxylate
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 6039-60-7 |
|---|---|
| SMILES | COC1=CC=CC2=C1C(=CC=C2)C(=O)OC |
| InChIKey | PCOVKQSYBZHUOP-UHFFFAOYSA-N |
Product Overview
Methyl 8-methoxynaphthalene-1-carboxylate (CAS 6039-60-7), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: methyl 8-methoxynaphthalene-1-carboxylate.
Chemical Property Profile of Methyl 8-methoxynaphthalene-1-carboxylate
Property Insights of Methyl 8-methoxynaphthalene-1-carboxylate
The XLogP value of 3.0 indicates that Methyl 8-methoxynaphthalene-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 8-methoxynaphthalene-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 8-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 Methyl 8-methoxynaphthalene-1-carboxylate?
The CAS number of Methyl 8-methoxynaphthalene-1-carboxylate is 6039-60-7.
What is the molecular formula of Methyl 8-methoxynaphthalene-1-carboxylate?
The molecular formula of Methyl 8-methoxynaphthalene-1-carboxylate is C13H12O3.
What is the molecular weight of Methyl 8-methoxynaphthalene-1-carboxylate?
The molecular weight of Methyl 8-methoxynaphthalene-1-carboxylate is 216.08 g/mol.
Where can I buy Methyl 8-methoxynaphthalene-1-carboxylate?
You can request a quote for Methyl 8-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 Methyl 8-methoxynaphthalene-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 8-methoxynaphthalene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.