2,4-Dimethoxybenzoic acid
TL;DR: 2,4-Dimethoxybenzoic acid (CAS 91-52-1) is a chemical compound with molecular formula C9H10O4 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethoxybenzoic acid
Also Known As: 2,4-DIMETHOXYBENZOIC ACID, Benzoic acid, 2,4-dimethoxy-, 2,4-dimethoxybenzoicacid, 24-Dimethoxybenzoate, 2.4-dimethoxybenzoic acid
| Molecular Formula | C9H10O4 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.0579 |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 91-52-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(=O)O)OC |
| InChIKey | GPVDHNVGGIAOQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dimethoxybenzoic acid (CAS 91-52-1), with molecular formula C9H10O4 and molecular weight 182.06 g/mol. IUPAC: 2,4-dimethoxybenzoic acid.
Chemical Property Profile of 2,4-Dimethoxybenzoic acid
Property Insights of 2,4-Dimethoxybenzoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethoxybenzoic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 2,4-Dimethoxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethoxybenzoic acid 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 2,4-Dimethoxybenzoic acid?
The CAS number of 2,4-Dimethoxybenzoic acid is 91-52-1.
What is the molecular formula of 2,4-Dimethoxybenzoic acid?
The molecular formula of 2,4-Dimethoxybenzoic acid is C9H10O4.
What is the molecular weight of 2,4-Dimethoxybenzoic acid?
The molecular weight of 2,4-Dimethoxybenzoic acid is 182.06 g/mol.
Where can I buy 2,4-Dimethoxybenzoic acid?
You can request a quote for 2,4-Dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.