5-Chloro-2-hydroxy-3-methoxybenzoic acid
TL;DR: 5-Chloro-2-hydroxy-3-methoxybenzoic acid (CAS 87964-77-0) is a chemical compound with molecular formula C8H7ClO4 and molecular weight 202.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-hydroxy-3-methoxybenzoic acid
Also Known As: 5-chloro-2-hydroxy-3-methoxybenzoic acid, TimTec1_005029, 3-methoxy-5-chlorosalicylic acid, Benzoic acid, 5-chloro-2-hydroxy-3-methoxy-, 5-chloro-2-hydroxy-3-methoxybenzoicacid
| Molecular Formula | C8H7ClO4 |
|---|---|
| Molecular Weight | 202.00 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.00328 |
| Heavy Atoms | 13 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 87964-77-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)C(=O)O)Cl |
| InChIKey | XIUGJQARSDULCU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloro-2-hydroxy-3-methoxybenzoic acid (CAS 87964-77-0), with molecular formula C8H7ClO4 and molecular weight 202.00 g/mol. IUPAC: 5-chloro-2-hydroxy-3-methoxybenzoic acid.
Chemical Property Profile of 5-Chloro-2-hydroxy-3-methoxybenzoic acid
Property Insights of 5-Chloro-2-hydroxy-3-methoxybenzoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-2-hydroxy-3-methoxybenzoic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-2-hydroxy-3-methoxybenzoic acid. Following Lipinski's Rule of Five, 5-Chloro-2-hydroxy-3-methoxybenzoic acid has 2 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 5-Chloro-2-hydroxy-3-methoxybenzoic acid?
The CAS number of 5-Chloro-2-hydroxy-3-methoxybenzoic acid is 87964-77-0.
What is the molecular formula of 5-Chloro-2-hydroxy-3-methoxybenzoic acid?
The molecular formula of 5-Chloro-2-hydroxy-3-methoxybenzoic acid is C8H7ClO4.
What is the molecular weight of 5-Chloro-2-hydroxy-3-methoxybenzoic acid?
The molecular weight of 5-Chloro-2-hydroxy-3-methoxybenzoic acid is 202.00 g/mol.
Where can I buy 5-Chloro-2-hydroxy-3-methoxybenzoic acid?
You can request a quote for 5-Chloro-2-hydroxy-3-methoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-2-hydroxy-3-methoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-hydroxy-3-methoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.