![5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid structure](/static/products/4382/438219-43-3.webp)
5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid
TL;DR: 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid (CAS 438219-43-3) is a chemical compound with molecular formula C16H17ClO4 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-chloro-5-methyl-2-propan-2-ylphenoxy)methyl]furan-2-carboxylic acid
Also Known As: 5-[(4-chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid, 5-{[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]methyl}furan-2-carboxylic acid, 5-(4-Chloro-2-isopropyl-5-methyl-phenoxymethyl)-furan-2-carboxylic acid, 5-((4-Chloro-2-isopropyl-5-methylphenoxy)methyl)furan-2-carboxylic acid, 5-[(4-chloro-5-methyl-2-propan-2-ylphenoxy)methyl]furan-2-carboxylic acid
| Molecular Formula | C16H17ClO4 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 4.64202 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.08154 |
| Heavy Atoms | 21 |
| Complexity | 658.29175 |
Chemical Identifiers
| CAS Number | 438219-43-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OCC2=CC=C(O2)C(=O)O |
Product Overview
5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid (CAS 438219-43-3), with molecular formula C16H17ClO4 and molecular weight 308.08 g/mol. IUPAC: 5-[(4-chloro-5-methyl-2-propan-2-ylphenoxy)methyl]furan-2-carboxylic acid.
Chemical Property Profile of 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid
Property Insights of 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid
The XLogP value of 4.64202 indicates that 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)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-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)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-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid?
The CAS number of 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid is 438219-43-3.
What is the molecular formula of 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid?
The molecular formula of 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid is C16H17ClO4.
What is the molecular weight of 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid?
The molecular weight of 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid is 308.08 g/mol.
Where can I buy 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid?
You can request a quote for 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)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-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Chloro-2-isopropyl-5-methylphenoxy)methyl]-2-furoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.