![5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid structure](/static/products/4382/438220-90-7.webp)
5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid
TL;DR: 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid (CAS 438220-90-7) is a chemical compound with molecular formula C12H7Cl3O4 and molecular weight 319.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,4,6-trichlorophenoxy)methyl]furan-2-carboxylic acid
Also Known As: 5-[(2,4,6-trichlorophenoxy)methyl]-2-furoic acid, 5-[(2,4,6-trichlorophenoxy)methyl]furan-2-carboxylic acid, 2-furancarboxylic acid, 5-[(2,4,6-trichlorophenoxy)methyl]-, 5-(2,4,6-Trichlorophenoxy)methyl-2-furoic acid, 5-[(2,4,6-trichlorophenoxy)methyl]-2-furoicacid
| Molecular Formula | C12H7Cl3O4 |
|---|---|
| Molecular Weight | 319.94 g/mol |
| LogP | 4.517 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.94098 |
| Heavy Atoms | 19 |
| Complexity | 598.1822 |
Chemical Identifiers
| CAS Number | 438220-90-7 |
|---|---|
| SMILES | C1=C(OC(=C1)C(=O)O)COC2=C(C=C(C=C2Cl)Cl)Cl |
Product Overview
5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid (CAS 438220-90-7), with molecular formula C12H7Cl3O4 and molecular weight 319.94 g/mol. IUPAC: 5-[(2,4,6-trichlorophenoxy)methyl]furan-2-carboxylic acid.
Chemical Property Profile of 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid
Property Insights of 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid
The XLogP value of 4.517 indicates that 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.67 Ų, 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic 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 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid?
The CAS number of 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid is 438220-90-7.
What is the molecular formula of 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid?
The molecular formula of 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid is C12H7Cl3O4.
What is the molecular weight of 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid?
The molecular weight of 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid is 319.94 g/mol.
Where can I buy 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid?
You can request a quote for 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2,4,6-Trichlorophenoxy)methyl]-2-furoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.