5-(3-chloro-2-fluorophenyl)-1H-pyrazole
TL;DR: 5-(3-chloro-2-fluorophenyl)-1H-pyrazole (CAS 149739-56-0) is a chemical compound with molecular formula C9H6ClFN2 and molecular weight 196.02036 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(3-chloro-2-fluorophenyl)-1H-pyrazole
Also Known As: 3-(3-chloro-2-fluorophenyl)-1H-pyrazole, 5-(3-chloro-2-fluorophenyl)-1H-pyrazole
Technical Specifications
| Molecular Formula | C9H6ClFN2 |
| Molecular Weight | 196.02036 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.02036 Da |
| Heavy Atoms | 13 |
| Complexity | 179.0 |
| SMILES | C1=CC(=C(C(=C1)Cl)F)C2=CC=NN2 |
| InChIKey | SEUUZEDVVSVWKS-UHFFFAOYSA-N |
Chemical Property Profile of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole
Property Insights of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-chloro-2-fluorophenyl)-1H-pyrazole. With a topological polar surface area (TPSA) of 28.7 Ų, 5-(3-chloro-2-fluorophenyl)-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3-chloro-2-fluorophenyl)-1H-pyrazole 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
What is the CAS number of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole?
The CAS number of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole is 149739-56-0.
What is the molecular formula of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole?
The molecular formula of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole is C9H6ClFN2.
What is the molecular weight of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole?
The molecular weight of 5-(3-chloro-2-fluorophenyl)-1H-pyrazole is 196.02036 g/mol.
Where can I buy 5-(3-chloro-2-fluorophenyl)-1H-pyrazole?
You can request a quote for 5-(3-chloro-2-fluorophenyl)-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(3-chloro-2-fluorophenyl)-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 5-(3-chloro-2-fluorophenyl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.