2,3,4,5-Tetrachloro-6-methoxybenzoic acid
TL;DR: 2,3,4,5-Tetrachloro-6-methoxybenzoic acid (CAS 110471-65-3) is a chemical compound with molecular formula C8H4Cl4O3 and molecular weight 287.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrachloro-6-methoxybenzoic acid
Also Known As: Benzoic acid, tetrachloromethoxy-, 2,3,4,5-tetrachloro-6-methoxybenzoic acid, Benzoic acid,tetrachloromethoxy- (9CI), Benzoic acid,tetrachloromethoxy-(9CI), 2,3,4,5-tetrachloro-6-methoxy-benzoic Acid
| Molecular Formula | C8H4Cl4O3 |
|---|---|
| Molecular Weight | 287.89 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.89145 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 110471-65-3 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O |
| InChIKey | ALPYPOJSXQUECF-UHFFFAOYSA-N |
Product Overview
2,3,4,5-Tetrachloro-6-methoxybenzoic acid (CAS 110471-65-3), with molecular formula C8H4Cl4O3 and molecular weight 287.89 g/mol. IUPAC: 2,3,4,5-tetrachloro-6-methoxybenzoic acid.
Chemical Property Profile of 2,3,4,5-Tetrachloro-6-methoxybenzoic acid
Property Insights of 2,3,4,5-Tetrachloro-6-methoxybenzoic acid
The XLogP value of 3.9 indicates that 2,3,4,5-Tetrachloro-6-methoxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2,3,4,5-Tetrachloro-6-methoxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5-Tetrachloro-6-methoxybenzoic 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 2,3,4,5-Tetrachloro-6-methoxybenzoic acid?
The CAS number of 2,3,4,5-Tetrachloro-6-methoxybenzoic acid is 110471-65-3.
What is the molecular formula of 2,3,4,5-Tetrachloro-6-methoxybenzoic acid?
The molecular formula of 2,3,4,5-Tetrachloro-6-methoxybenzoic acid is C8H4Cl4O3.
What is the molecular weight of 2,3,4,5-Tetrachloro-6-methoxybenzoic acid?
The molecular weight of 2,3,4,5-Tetrachloro-6-methoxybenzoic acid is 287.89 g/mol.
Where can I buy 2,3,4,5-Tetrachloro-6-methoxybenzoic acid?
You can request a quote for 2,3,4,5-Tetrachloro-6-methoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5-Tetrachloro-6-methoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5-Tetrachloro-6-methoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.