2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline
TL;DR: 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline (CAS 66685-32-3) is a chemical compound with molecular formula C10H8F3N3 and molecular weight 227.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)aniline
Also Known As: 2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)aniline, 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline
| Molecular Formula | C10H8F3N3 |
|---|---|
| Molecular Weight | 227.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.06703 |
| Heavy Atoms | 16 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 66685-32-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)N)C2=CC=NN2 |
| InChIKey | RGXNKVICQJTJFD-UHFFFAOYSA-N |
Product Overview
2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline (CAS 66685-32-3), with molecular formula C10H8F3N3 and molecular weight 227.07 g/mol. IUPAC: 2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)aniline.
Chemical Property Profile of 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline
Property Insights of 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline. With a topological polar surface area (TPSA) of 54.7 Ų, 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline has 2 hydrogen bond donor(s) and 5 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-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline?
The CAS number of 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline is 66685-32-3.
What is the molecular formula of 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline?
The molecular formula of 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline is C10H8F3N3.
What is the molecular weight of 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline?
The molecular weight of 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline is 227.07 g/mol.
Where can I buy 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline?
You can request a quote for 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-(2H-pyrazol-3-yl)-5-(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.