4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole
TL;DR: 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole (CAS 1029636-02-9) is a chemical compound with molecular formula C10H7ClF2N2 and molecular weight 228.02658 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-5-(difluoromethyl)-3-phenyl-1H-pyrazole
Also Known As: 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole, 4-Chloro-3-difluoromethyl-5-phenylpyrazole, 4-chloro-5-(difluoromethyl)-3-phenyl-1H-pyrazole, 4-Chloro-3(5)-difluoromethyl-5(3)-phenylpyrazole, 3-(difluoromethyl)-4-chloro-5-phenylpyrazole
Technical Specifications
| Molecular Formula | C10H7ClF2N2 |
| Molecular Weight | 228.02658 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.02658 Da |
| Heavy Atoms | 15 |
| Complexity | 210.0 |
| SMILES | C1=CC=C(C=C1)C2=NNC(=C2Cl)C(F)F |
| InChIKey | QLUXJNQEZRMMAF-UHFFFAOYSA-N |
Chemical Property Profile of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole
Property Insights of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole
The XLogP value of 3.2 indicates that 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole?
The CAS number of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole is 1029636-02-9.
What is the molecular formula of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole?
The molecular formula of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole is C10H7ClF2N2.
What is the molecular weight of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole?
The molecular weight of 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole is 228.02658 g/mol.
Where can I buy 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole?
You can request a quote for 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 4-chloro-3-(difluoromethyl)-5-phenyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.