1-乙酰氧肟酸-3-硝基吡唑
TL;DR: 1-乙酰氧肟酸-3-硝基吡唑 (CAS 93677-02-2) is a chemical compound with molecular formula C5H6N4O4 and molecular weight 186.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-乙酰氧肟酸-3-硝基吡唑
N-hydroxy-2-(3-nitropyrazol-1-yl)acetamide
Also Known As: Djw 258, 1-Acetohydroxamic acid-3-nitropyrazole, N-hydroxy-2-(3-nitropyrazol-1-yl)acetamide, N-Hydroxy-2-(3-nitro-1H-pyrazol-1-yl)acetamide, 1H-Pyrazole-1-acetamide, N-hydroxy-3-nitro-, (R-(R*,S*-(E)))-
| Molecular Formula | C5H6N4O4 |
|---|---|
| Molecular Weight | 186.04 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.03891 |
| Heavy Atoms | 13 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 93677-02-2 |
|---|---|
| SMILES | C1=CN(N=C1[N+](=O)[O-])CC(=O)NO |
| InChIKey | YPTMGEJOWGQWNX-UHFFFAOYSA-N |
Product Overview
1-乙酰氧肟酸-3-硝基吡唑 (CAS 93677-02-2), with molecular formula C5H6N4O4 and molecular weight 186.04 g/mol. IUPAC: N-hydroxy-2-(3-nitropyrazol-1-yl)acetamide.
Chemical Property Profile of 1-乙酰氧肟酸-3-硝基吡唑
Property Insights of 1-乙酰氧肟酸-3-硝基吡唑
The XLogP value of -0.6 indicates that 1-乙酰氧肟酸-3-硝基吡唑 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-乙酰氧肟酸-3-硝基吡唑. Following Lipinski's Rule of Five, 1-乙酰氧肟酸-3-硝基吡唑 has 2 hydrogen bond donor(s) and 5 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-乙酰氧肟酸-3-硝基吡唑?
The CAS number of 1-乙酰氧肟酸-3-硝基吡唑 is 93677-02-2.
What is the molecular formula of 1-乙酰氧肟酸-3-硝基吡唑?
The molecular formula of 1-乙酰氧肟酸-3-硝基吡唑 is C5H6N4O4.
What is the molecular weight of 1-乙酰氧肟酸-3-硝基吡唑?
The molecular weight of 1-乙酰氧肟酸-3-硝基吡唑 is 186.04 g/mol.
Where can I buy 1-乙酰氧肟酸-3-硝基吡唑?
You can request a quote for 1-乙酰氧肟酸-3-硝基吡唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-乙酰氧肟酸-3-硝基吡唑?
Yes, KEHONG BIO provides custom synthesis services for 1-乙酰氧肟酸-3-硝基吡唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.