2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline
TL;DR: 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline (CAS 1431964-31-6) is a chemical compound with molecular formula C10H8F3N3 and molecular weight 227.06703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-pyrazol-1-yl-5-(trifluoromethyl)aniline
Also Known As: 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline, 2-pyrazol-1-yl-5-(trifluoromethyl)aniline, Benzenamine, 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)-, 2-pyrazolyl-5-(trifluoromethyl)phenylamine, 2-pyrazol-1-yl-5-trifluoromethyl-phenylamine
Technical Specifications
| Molecular Formula | C10H8F3N3 |
| Molecular Weight | 227.06703 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.06703 Da |
| Heavy Atoms | 16 |
| Complexity | 244.0 |
| SMILES | C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)N |
| InChIKey | VLUQHVNLXBAREY-UHFFFAOYSA-N |
Chemical Property Profile of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline
Property Insights of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline. With a topological polar surface area (TPSA) of 43.8 Ų, 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline?
The CAS number of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline is 1431964-31-6.
What is the molecular formula of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline?
The molecular formula of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline is C10H8F3N3.
What is the molecular weight of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline?
The molecular weight of 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline is 227.06703 g/mol.
Where can I buy 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline?
You can request a quote for 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline?
Yes, CoreyChem provides custom synthesis services for 2-(1H-pyrazol-1-yl)-5-(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.