3,5-Dichloro-4-ethoxybenzoic acid
TL;DR: 3,5-Dichloro-4-ethoxybenzoic acid (CAS 41490-08-8) is a chemical compound with molecular formula C9H8Cl2O3 and molecular weight 233.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dichloro-4-ethoxybenzoic acid
Also Known As: 3,5-dichloro-4-ethoxybenzoic acid, Dotinurad Impurity 175, 3,5-dichloro-4-ethoxy-benzoic acid, AN-979/41104467, 888-338-2
| Molecular Formula | C9H8Cl2O3 |
|---|---|
| Molecular Weight | 233.99 g/mol |
| LogP | 3.0903 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.98505 |
| Heavy Atoms | 14 |
| Complexity | 340.06985 |
Chemical Identifiers
| CAS Number | 41490-08-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1Cl)C(=O)O)Cl |
Product Overview
3,5-Dichloro-4-ethoxybenzoic acid (CAS 41490-08-8), with molecular formula C9H8Cl2O3 and molecular weight 233.99 g/mol. IUPAC: 3,5-dichloro-4-ethoxybenzoic acid.
Chemical Property Profile of 3,5-Dichloro-4-ethoxybenzoic acid
Property Insights of 3,5-Dichloro-4-ethoxybenzoic acid
The XLogP value of 3.0903 indicates that 3,5-Dichloro-4-ethoxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 3,5-Dichloro-4-ethoxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dichloro-4-ethoxybenzoic acid has 1 hydrogen bond donor(s) and 2 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 3,5-Dichloro-4-ethoxybenzoic acid?
The CAS number of 3,5-Dichloro-4-ethoxybenzoic acid is 41490-08-8.
What is the molecular formula of 3,5-Dichloro-4-ethoxybenzoic acid?
The molecular formula of 3,5-Dichloro-4-ethoxybenzoic acid is C9H8Cl2O3.
What is the molecular weight of 3,5-Dichloro-4-ethoxybenzoic acid?
The molecular weight of 3,5-Dichloro-4-ethoxybenzoic acid is 233.99 g/mol.
Where can I buy 3,5-Dichloro-4-ethoxybenzoic acid?
You can request a quote for 3,5-Dichloro-4-ethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dichloro-4-ethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dichloro-4-ethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.