1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole
TL;DR: 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole (CAS 1001519-18-1) is a chemical compound with molecular formula C12H11F2N3O3 and molecular weight 283.07684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2,4-difluorophenoxy)methyl]-3,5-dimethyl-4-nitropyrazole
Also Known As: 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole, 1-[(2,4-difluorophenoxy)methyl]-3,5-dimethyl-4-nitro-1H-pyrazole, 1-[(2,4-difluorophenoxy)methyl]-3,5-dimethyl-4-nitro-pyrazole, 1-(2,4-Difluoro-phenoxymethyl)-3,5-dimethyl-4-nitro-1H-pyrazole, 1-[(2,4-difluorophenoxy)methyl]-3,5-dimethyl-4-nitropyrazole
Technical Specifications
| Molecular Formula | C12H11F2N3O3 |
| Molecular Weight | 283.07684 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.07684 Da |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
| SMILES | CC1=C(C(=NN1COC2=C(C=C(C=C2)F)F)C)[N+](=O)[O-] |
| InChIKey | OIBQNBUQDFXKSN-UHFFFAOYSA-N |
Chemical Property Profile of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole
Property Insights of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole. Following Lipinski's Rule of Five, 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole?
The CAS number of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole is 1001519-18-1.
What is the molecular formula of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole?
The molecular formula of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole is C12H11F2N3O3.
What is the molecular weight of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole?
The molecular weight of 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole is 283.07684 g/mol.
Where can I buy 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole?
You can request a quote for 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 1-((2,4-Difluorophenoxy)methyl)-3,5-dimethyl-4-nitro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.