![3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid structure](/static/products/955/955963-65-2.png)
3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid
TL;DR: 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid (CAS 955963-65-2) is a chemical compound with molecular formula C17H11F3N2O2 and molecular weight 332.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic acid
Also Known As: 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid, 3-{4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-1-yl}benzenecarboxylic acid, 3-{4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-1-yl}benzoic acid, 3-{4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl}benzoic acid, 3-{4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-1-yl}benzoicacid
| Molecular Formula | C17H11F3N2O2 |
|---|---|
| Molecular Weight | 332.08 g/mol |
| LogP | 4.2563 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.07727 |
| Heavy Atoms | 24 |
| Complexity | 900.6014 |
Chemical Identifiers
| CAS Number | 955963-65-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C2=CN(N=C2)C3=CC=CC(=C3)C(=O)O |
Product Overview
3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid (CAS 955963-65-2), with molecular formula C17H11F3N2O2 and molecular weight 332.08 g/mol. IUPAC: 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic acid.
Chemical Property Profile of 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid
Property Insights of 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid
The XLogP value of 4.2563 indicates that 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.12 Ų, 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic 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 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid?
The CAS number of 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid is 955963-65-2.
What is the molecular formula of 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid?
The molecular formula of 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid is C17H11F3N2O2.
What is the molecular weight of 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid?
The molecular weight of 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid is 332.08 g/mol.
Where can I buy 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid?
You can request a quote for 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-[3-(trifluoromethyl)phenyl]pyrazol-1-yl]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.