![2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid structure](/static/products/4780/478030-67-0.webp)
2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid
TL;DR: 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid (CAS 478030-67-0) is a chemical compound with molecular formula C11H7F3N2O3 and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]acetic acid
Also Known As: 2-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid, 2R-1579, 2-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]acetic Acid
| Molecular Formula | C11H7F3N2O3 |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 2.3825 |
| Topological Polar Surface Area | 76.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.04086 |
| Heavy Atoms | 19 |
| Complexity | 607.228 |
Chemical Identifiers
| CAS Number | 478030-67-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C2=NOC(=N2)CC(=O)O |
Product Overview
2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid (CAS 478030-67-0), with molecular formula C11H7F3N2O3 and molecular weight 272.04 g/mol. IUPAC: 2-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]acetic acid.
Chemical Property Profile of 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid
Property Insights of 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid
The XLogP value of 2.3825 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid. The TPSA of 76.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid. Following Lipinski's Rule of Five, 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid has 1 hydrogen bond donor(s) and 4 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-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid?
The CAS number of 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid is 478030-67-0.
What is the molecular formula of 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid?
The molecular formula of 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid is C11H7F3N2O3.
What is the molecular weight of 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid?
The molecular weight of 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid is 272.04 g/mol.
Where can I buy 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid?
You can request a quote for 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{3-[3-(Trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.