4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid
TL;DR: 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid (CAS 339253-95-1) is a chemical compound with molecular formula C13H11ClO4 and molecular weight 266.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-chlorophenoxy)methyl]-5-methylfuran-2-carboxylic acid
Also Known As: 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid, 4-[(2-chlorophenoxy)methyl]-5-methylfuran-2-carboxylic acid, 4-[(2-chlorophenoxy)methyl]-5-methyl-2-furoic acid, 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylicacid, 4-[(2-chlorophenoxy)methyl]-5-methyl-furan-2-carboxylic acid
| Molecular Formula | C13H11ClO4 |
|---|---|
| Molecular Weight | 266.03 g/mol |
| LogP | 3.51862 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.03458 |
| Heavy Atoms | 18 |
| Complexity | 574.12024 |
Chemical Identifiers
| CAS Number | 339253-95-1 |
|---|---|
| SMILES | CC1=C(C=C(O1)C(=O)O)COC2=CC=CC=C2Cl |
Product Overview
4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid (CAS 339253-95-1), with molecular formula C13H11ClO4 and molecular weight 266.03 g/mol. IUPAC: 4-[(2-chlorophenoxy)methyl]-5-methylfuran-2-carboxylic acid.
Chemical Property Profile of 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid
Property Insights of 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid
The XLogP value of 3.51862 indicates that 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic 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, 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic 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-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid?
The CAS number of 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid is 339253-95-1.
What is the molecular formula of 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid?
The molecular formula of 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid is C13H11ClO4.
What is the molecular weight of 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid?
The molecular weight of 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid is 266.03 g/mol.
Where can I buy 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid?
You can request a quote for 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((2-Chlorophenoxy)methyl)-5-methylfuran-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.