2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid
TL;DR: 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid (CAS 71074-91-4) is a chemical compound with molecular formula C12H13F3O3 and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2,2-trifluoro-1-phenylethoxy)butanoic acid
Also Known As: 2- BUTYRICACID, EINECS 275-163-6, 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid, 2-(2,2,2-trifluoro-1-phenylethoxy)butanoic acid, Butanoic acid,2-(2,2,2-trifluoro-1-phenylethoxy)-
| Molecular Formula | C12H13F3O3 |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 3.1698 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.08167 |
| Heavy Atoms | 18 |
| Complexity | 389.30414 |
Chemical Identifiers
| CAS Number | 71074-91-4 |
|---|---|
| SMILES | CCC(C(=O)O)OC(C1=CC=CC=C1)C(F)(F)F |
Product Overview
2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid (CAS 71074-91-4), with molecular formula C12H13F3O3 and molecular weight 262.08 g/mol. IUPAC: 2-(2,2,2-trifluoro-1-phenylethoxy)butanoic acid.
Chemical Property Profile of 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid
Property Insights of 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid
The XLogP value of 3.1698 indicates that 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric 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 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid?
The CAS number of 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid is 71074-91-4.
What is the molecular formula of 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid?
The molecular formula of 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid is C12H13F3O3.
What is the molecular weight of 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid?
The molecular weight of 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid is 262.08 g/mol.
Where can I buy 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid?
You can request a quote for 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2,2-Trifluoro-1-phenylethoxy)butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.