5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid
TL;DR: 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid (CAS 499-55-8) is a chemical compound with molecular formula C12H6ClF3O3 and molecular weight 290.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid
Also Known As: 5-(4-chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid, 3-Fluorobenzhydrazide, Maybridge1_008497, 4-Phenylenediglyoxal dihydrate, 5-(4-Chlorophenyl)-2-(Trifluoromethyl)-3-Furoic Acid
| Molecular Formula | C12H6ClF3O3 |
|---|---|
| Molecular Weight | 290.00 g/mol |
| LogP | 4.317 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.99576 |
| Heavy Atoms | 19 |
| Complexity | 614.14014 |
Chemical Identifiers
| CAS Number | 499-55-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC(=C(O2)C(F)(F)F)C(=O)O)Cl |
Product Overview
5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid (CAS 499-55-8), with molecular formula C12H6ClF3O3 and molecular weight 290.00 g/mol. IUPAC: 5-(4-chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid.
Chemical Property Profile of 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid
Property Insights of 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid
The XLogP value of 4.317 indicates that 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.44 Ų, 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic 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 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid?
The CAS number of 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid is 499-55-8.
What is the molecular formula of 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid?
The molecular formula of 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid is C12H6ClF3O3.
What is the molecular weight of 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid?
The molecular weight of 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid is 290.00 g/mol.
Where can I buy 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid?
You can request a quote for 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic 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-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Chlorophenyl)-2-(trifluoromethyl)furan-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.