![1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone structure](/static/products/2440/244033-12-3.webp)
1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone
TL;DR: 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone (CAS 244033-12-3) is a chemical compound with molecular formula C9H6F7N3O3 and molecular weight 337.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone
Also Known As: 1-Acetyl-3(5)-heptafluoropropyl-5(3)-methyl-4-nitropyrazole, 1-Acetyl-3-heptafluoropropyl-5-methyl-4-nitropyrazole, 1-[3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone, 1-Acetyl-3(5)-(heptafluoropropyl)-5(3)-methyl-4-nitropyrazole, 1-ACETYL-3(5)-(HEPTAFLUORO-1-PROPYL)-5(3)-METHYL-4-(NITRO)PYRAZOLE
| Molecular Formula | C9H6F7N3O3 |
|---|---|
| Molecular Weight | 337.03 g/mol |
| LogP | 3.04922 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.02972 |
| Heavy Atoms | 22 |
| Complexity | 635.13513 |
Chemical Identifiers
| CAS Number | 244033-12-3 |
|---|---|
| SMILES | CC1=C(C(=NN1C(=O)C)C(C(C(F)(F)F)(F)F)(F)F)[N+](=O)[O-] |
Product Overview
1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone (CAS 244033-12-3), with molecular formula C9H6F7N3O3 and molecular weight 337.03 g/mol. IUPAC: 1-[3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone.
Chemical Property Profile of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone
Property Insights of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone
The XLogP value of 3.04922 indicates that 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone. Following Lipinski's Rule of Five, 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone?
The CAS number of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone is 244033-12-3.
What is the molecular formula of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone?
The molecular formula of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone is C9H6F7N3O3.
What is the molecular weight of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone?
The molecular weight of 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone is 337.03 g/mol.
Where can I buy 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone?
You can request a quote for 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(1,1,2,2,3,3,3-Heptafluoropropyl)-5-methyl-4-nitropyrazol-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.