4-Bromo-3,5-dimethoxybenzoic acid
TL;DR: 4-Bromo-3,5-dimethoxybenzoic acid (CAS 56518-42-4) is a chemical compound with molecular formula C9H9BrO4 and molecular weight 259.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-3,5-dimethoxybenzoic acid
Also Known As: 4-Bromo-3,5-dimethoxybenzoic acid, zlchem 1334, JNFZULSIYYVRJO-UHFFFAOYSA-, Benzoic acid, 4-bromo-3,5-dimethoxy-, 4-bromo-3,5-dimethoxy-benzoic Acid
| Molecular Formula | C9H9BrO4 |
|---|---|
| Molecular Weight | 259.97 g/mol |
| LogP | 2.1645 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.9684 |
| Heavy Atoms | 14 |
| Complexity | 336.82474 |
Chemical Identifiers
| CAS Number | 56518-42-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1Br)OC)C(=O)O |
Product Overview
4-Bromo-3,5-dimethoxybenzoic acid (CAS 56518-42-4), with molecular formula C9H9BrO4 and molecular weight 259.97 g/mol. IUPAC: 4-bromo-3,5-dimethoxybenzoic acid.
Chemical Property Profile of 4-Bromo-3,5-dimethoxybenzoic acid
Property Insights of 4-Bromo-3,5-dimethoxybenzoic acid
The XLogP value of 2.1645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-3,5-dimethoxybenzoic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 4-Bromo-3,5-dimethoxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-3,5-dimethoxybenzoic acid has 1 hydrogen bond donor(s) and 3 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 4-Bromo-3,5-dimethoxybenzoic acid?
The CAS number of 4-Bromo-3,5-dimethoxybenzoic acid is 56518-42-4.
What is the molecular formula of 4-Bromo-3,5-dimethoxybenzoic acid?
The molecular formula of 4-Bromo-3,5-dimethoxybenzoic acid is C9H9BrO4.
What is the molecular weight of 4-Bromo-3,5-dimethoxybenzoic acid?
The molecular weight of 4-Bromo-3,5-dimethoxybenzoic acid is 259.97 g/mol.
Where can I buy 4-Bromo-3,5-dimethoxybenzoic acid?
You can request a quote for 4-Bromo-3,5-dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-3,5-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-3,5-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.