5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid
TL;DR: 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid (CAS 883241-39-2) is a chemical compound with molecular formula C10H9F3O4 and molecular weight 250.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid
Also Known As: 5-methoxy-2-(2,2,2-trifluoroethoxy)benzoic Acid, 3-Trifluoromethyl-4-hydroxy-5-methoxy Methyl Benzoate, Benzoic acid,5-methoxy-2-(2,2,2-trifluoroethoxy)-, 3-Carboxy-4-(2,2,2-trifluoroethoxy)anisole, 5-METHOXY-2-(2,2,2-TRIFLUOROETHOXY)BENZOICACID
| Molecular Formula | C10H9F3O4 |
|---|---|
| Molecular Weight | 250.05 g/mol |
| LogP | 2.3345 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.04529 |
| Heavy Atoms | 17 |
| Complexity | 414.50232 |
Chemical Identifiers
| CAS Number | 883241-39-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OCC(F)(F)F)C(=O)O |
Product Overview
5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid (CAS 883241-39-2), with molecular formula C10H9F3O4 and molecular weight 250.05 g/mol. IUPAC: 5-methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid.
Chemical Property Profile of 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid
Property Insights of 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid
The XLogP value of 2.3345 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic 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-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid?
The CAS number of 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid is 883241-39-2.
What is the molecular formula of 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid?
The molecular formula of 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid is C10H9F3O4.
What is the molecular weight of 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid?
The molecular weight of 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid is 250.05 g/mol.
Where can I buy 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid?
You can request a quote for 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Methoxy-2-(2,2,2-trifluoroethoxy)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.