5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid
TL;DR: 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid (CAS 17515-74-1) is a chemical compound with molecular formula C7H5F3O3 and molecular weight 194.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-(trifluoromethyl)furan-3-carboxylic acid
Also Known As: 5-methyl-2-(trifluoromethyl)furan-3-carboxylic Acid, Bromfenac, 5-METHYL-2-(TRIFLUOROMETHYL)-3-FUROIC ACID, 3-Furancarboxylic acid, 5-methyl-2-(trifluoromethyl)-, 2-trifluoromethyl-5-methyl-3-furancarboxylic acid
| Molecular Formula | C7H5F3O3 |
|---|---|
| Molecular Weight | 194.02 g/mol |
| LogP | 2.30502 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.01907 |
| Heavy Atoms | 13 |
| Complexity | 337.24225 |
Chemical Identifiers
| CAS Number | 17515-74-1 |
|---|---|
| SMILES | CC1=CC(=C(O1)C(F)(F)F)C(=O)O |
Product Overview
5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid (CAS 17515-74-1), with molecular formula C7H5F3O3 and molecular weight 194.02 g/mol. IUPAC: 5-methyl-2-(trifluoromethyl)furan-3-carboxylic acid.
Chemical Property Profile of 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid
Property Insights of 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid
The XLogP value of 2.30502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid. With a topological polar surface area (TPSA) of 50.44 Ų, 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic 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-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid?
The CAS number of 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid is 17515-74-1.
What is the molecular formula of 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid?
The molecular formula of 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid is C7H5F3O3.
What is the molecular weight of 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid?
The molecular weight of 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid is 194.02 g/mol.
Where can I buy 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid?
You can request a quote for 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-(trifluoromethyl)-3-furancarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.