3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole
TL;DR: 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole (CAS 1029636-42-7) is a chemical compound with molecular formula C11H10F2N2O and molecular weight 224.07613 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(difluoromethyl)-3-(4-methoxyphenyl)-1H-pyrazole
Also Known As: 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole, 3-(difluoromethyl)-5-(4-methoxyphenyl)-1H-pyrazole, 5-(difluoromethyl)-3-(4-methoxyphenyl)-1H-pyrazole, 3(5)-Difluoromethyl-5(3)-(4-methoxyphenyl)pyrazole, 3-(difluoromethyl)-5-(4-methoxyphenyl)-2H-pyrazole
Technical Specifications
| Molecular Formula | C11H10F2N2O |
| Molecular Weight | 224.07613 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 37.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.07613 Da |
| Heavy Atoms | 16 |
| Complexity | 220.0 |
| SMILES | COC1=CC=C(C=C1)C2=NNC(=C2)C(F)F |
| InChIKey | RQTLTZHBBOVPLZ-UHFFFAOYSA-N |
Chemical Property Profile of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole
Property Insights of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole. With a topological polar surface area (TPSA) of 37.9 Ų, 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole?
The CAS number of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole is 1029636-42-7.
What is the molecular formula of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole?
The molecular formula of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole is C11H10F2N2O.
What is the molecular weight of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole?
The molecular weight of 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole is 224.07613 g/mol.
Where can I buy 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole?
You can request a quote for 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole?
Yes, CoreyChem provides custom synthesis services for 3-Difluoromethyl-5-(4-methoxyphenyl)pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.