Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester
TL;DR: Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester (CAS 87-16-1) is a chemical compound with molecular formula C14H12O4 and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxyphenyl) 2-hydroxybenzoate
Also Known As: Guaiacol salicylate, Guaiacol salol, 'Guaiacol salol', 2-Methoxyphenyl salicylate, (2-methoxyphenyl) 2-hydroxybenzoate
| Molecular Formula | C14H12O4 |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.07356 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 87-16-1 |
|---|---|
| SMILES | COC1=CC=CC=C1OC(=O)C2=CC=CC=C2O |
| InChIKey | APMWEQQELZTXTL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester (CAS 87-16-1), with molecular formula C14H12O4 and molecular weight 244.07 g/mol. IUPAC: (2-methoxyphenyl) 2-hydroxybenzoate.
Chemical Property Profile of Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester
Property Insights of Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester
The XLogP value of 3.6 indicates that Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester 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 Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester?
The CAS number of Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester is 87-16-1.
What is the molecular formula of Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester?
The molecular formula of Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester is C14H12O4.
What is the molecular weight of Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester?
The molecular weight of Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester is 244.07 g/mol.
Where can I buy Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester?
You can request a quote for Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-hydroxy-, 2-methoxyphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.