2-(Trifluoromethoxy)terephthalic acid
TL;DR: 2-(Trifluoromethoxy)terephthalic acid (CAS 175278-21-4) is a chemical compound with molecular formula C9H5F3O5 and molecular weight 250.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(trifluoromethoxy)terephthalic acid
Also Known As: 2-(trifluoromethoxy)terephthalic acid, 2-(trifluoromethoxy)benzene-1,4-dicarboxylic acid, rarechem al bo 0792, MixCom1_000193, Maybridge1_000105
| Molecular Formula | C9H5F3O5 |
|---|---|
| Molecular Weight | 250.01 g/mol |
| LogP | 1.9816 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.00891 |
| Heavy Atoms | 17 |
| Complexity | 466.1894 |
Chemical Identifiers
| CAS Number | 175278-21-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)OC(F)(F)F)C(=O)O |
Product Overview
2-(Trifluoromethoxy)terephthalic acid (CAS 175278-21-4), with molecular formula C9H5F3O5 and molecular weight 250.01 g/mol. IUPAC: 2-(trifluoromethoxy)terephthalic acid.
Chemical Property Profile of 2-(Trifluoromethoxy)terephthalic acid
Property Insights of 2-(Trifluoromethoxy)terephthalic acid
The XLogP value of 1.9816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Trifluoromethoxy)terephthalic acid. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Trifluoromethoxy)terephthalic acid. Following Lipinski's Rule of Five, 2-(Trifluoromethoxy)terephthalic acid has 2 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-(Trifluoromethoxy)terephthalic acid?
The CAS number of 2-(Trifluoromethoxy)terephthalic acid is 175278-21-4.
What is the molecular formula of 2-(Trifluoromethoxy)terephthalic acid?
The molecular formula of 2-(Trifluoromethoxy)terephthalic acid is C9H5F3O5.
What is the molecular weight of 2-(Trifluoromethoxy)terephthalic acid?
The molecular weight of 2-(Trifluoromethoxy)terephthalic acid is 250.01 g/mol.
Where can I buy 2-(Trifluoromethoxy)terephthalic acid?
You can request a quote for 2-(Trifluoromethoxy)terephthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Trifluoromethoxy)terephthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Trifluoromethoxy)terephthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.