2-Hydroxy-3,4-dimethoxybenzoic acid
TL;DR: 2-Hydroxy-3,4-dimethoxybenzoic acid (CAS 5653-46-3) is a chemical compound with molecular formula C9H10O5 and molecular weight 198.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3,4-dimethoxybenzoic acid
Also Known As: 2-Hydroxy-3,4-dimethoxybenzoic acid, 3,4-Dimethoxysalicylic acid, Spectrum2_001921, Spectrum3_001124, Spectrum4_001968
| Molecular Formula | C9H10O5 |
|---|---|
| Molecular Weight | 198.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.05283 |
| Heavy Atoms | 14 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 5653-46-3 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C(=O)O)O)OC |
| InChIKey | CJFQIVAOBBTJCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxy-3,4-dimethoxybenzoic acid (CAS 5653-46-3), with molecular formula C9H10O5 and molecular weight 198.05 g/mol. IUPAC: 2-hydroxy-3,4-dimethoxybenzoic acid.
Chemical Property Profile of 2-Hydroxy-3,4-dimethoxybenzoic acid
Property Insights of 2-Hydroxy-3,4-dimethoxybenzoic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-3,4-dimethoxybenzoic acid. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-3,4-dimethoxybenzoic acid. Following Lipinski's Rule of Five, 2-Hydroxy-3,4-dimethoxybenzoic acid has 2 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 2-Hydroxy-3,4-dimethoxybenzoic acid?
The CAS number of 2-Hydroxy-3,4-dimethoxybenzoic acid is 5653-46-3.
What is the molecular formula of 2-Hydroxy-3,4-dimethoxybenzoic acid?
The molecular formula of 2-Hydroxy-3,4-dimethoxybenzoic acid is C9H10O5.
What is the molecular weight of 2-Hydroxy-3,4-dimethoxybenzoic acid?
The molecular weight of 2-Hydroxy-3,4-dimethoxybenzoic acid is 198.05 g/mol.
Where can I buy 2-Hydroxy-3,4-dimethoxybenzoic acid?
You can request a quote for 2-Hydroxy-3,4-dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-3,4-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-3,4-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.