2-Methoxy-4-(trifluoromethoxy)phenylacetic acid
TL;DR: 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid (CAS 886500-45-4) 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.
2-[2-methoxy-4-(trifluoromethoxy)phenyl]acetic acid
Also Known As: 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid, 2-(2-Methoxy-4-(trifluoromethoxy)phenyl)acetic acid, 2-[2-methoxy-4-(trifluoromethoxy)phenyl]acetic Acid, 2-(2-Methoxy-4-(trifluoromethoxy)phenyl)aceticacid, 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid, 97%
| Molecular Formula | C10H9F3O4 |
|---|---|
| Molecular Weight | 250.05 g/mol |
| LogP | 2.2209 |
| 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 | 886500-45-4 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)OC(F)(F)F)CC(=O)O |
Product Overview
2-Methoxy-4-(trifluoromethoxy)phenylacetic acid (CAS 886500-45-4), with molecular formula C10H9F3O4 and molecular weight 250.05 g/mol. IUPAC: 2-[2-methoxy-4-(trifluoromethoxy)phenyl]acetic acid.
Chemical Property Profile of 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid
Property Insights of 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid
The XLogP value of 2.2209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-4-(trifluoromethoxy)phenylacetic 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 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid?
The CAS number of 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid is 886500-45-4.
What is the molecular formula of 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid?
The molecular formula of 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid is C10H9F3O4.
What is the molecular weight of 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid?
The molecular weight of 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid is 250.05 g/mol.
Where can I buy 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid?
You can request a quote for 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-4-(trifluoromethoxy)phenylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.