Methyl 2-naphthoate
TL;DR: Methyl 2-naphthoate (CAS 2459-25-8) is a chemical compound with molecular formula C12H10O2 and molecular weight 186.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl naphthalene-2-carboxylate
Also Known As: Methyl 2-naphthoate, methyl naphthalene-2-carboxylate, 2-Naphthalenecarboxylic acid, methyl ester, Methyl 2-naphthalenecarboxylate, 2-Carbomethoxynaphthalene
| Molecular Formula | C12H10O2 |
|---|---|
| Molecular Weight | 186.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.06808 |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 2459-25-8 |
|---|---|
| SMILES | COC(=O)C1=CC2=CC=CC=C2C=C1 |
| InChIKey | IODOXLXFXNATGI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-naphthoate (CAS 2459-25-8), with molecular formula C12H10O2 and molecular weight 186.07 g/mol. IUPAC: methyl naphthalene-2-carboxylate.
Chemical Property Profile of Methyl 2-naphthoate
Property Insights of Methyl 2-naphthoate
The XLogP value of 3.6 indicates that Methyl 2-naphthoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 2-naphthoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-naphthoate has 0 hydrogen bond donor(s) and 2 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 2-naphthoate?
The CAS number of Methyl 2-naphthoate is 2459-25-8.
What is the molecular formula of Methyl 2-naphthoate?
The molecular formula of Methyl 2-naphthoate is C12H10O2.
What is the molecular weight of Methyl 2-naphthoate?
The molecular weight of Methyl 2-naphthoate is 186.07 g/mol.
Where can I buy Methyl 2-naphthoate?
You can request a quote for Methyl 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 2-naphthoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-naphthoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.