4-nitro-1H-pyrazol-1-amine
TL;DR: 4-nitro-1H-pyrazol-1-amine (CAS 3994-40-9) is a chemical compound with molecular formula C3H4N4O2 and molecular weight 128.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitropyrazol-1-amine
Also Known As: 4-nitro-1H-pyrazol-1-amine, 4-nitropyrazol-1-amine, 4-Nitro-pyrazol-1-ylamine, 4-nitropyrazolylamine, 4-Nitropyrazol-1-ylamine
| Molecular Formula | C3H4N4O2 |
|---|---|
| Molecular Weight | 128.03 g/mol |
| LogP | -0.4949 |
| Topological Polar Surface Area | 86.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 128.03343 |
| Heavy Atoms | 9 |
| Complexity | 229.47154 |
Chemical Identifiers
| CAS Number | 3994-40-9 |
|---|---|
| SMILES | C1=C(C=NN1N)[N+](=O)[O-] |
Product Overview
4-nitro-1H-pyrazol-1-amine (CAS 3994-40-9), with molecular formula C3H4N4O2 and molecular weight 128.03 g/mol. IUPAC: 4-nitropyrazol-1-amine.
Chemical Property Profile of 4-nitro-1H-pyrazol-1-amine
Property Insights of 4-nitro-1H-pyrazol-1-amine
The XLogP value of -0.4949 indicates that 4-nitro-1H-pyrazol-1-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-1H-pyrazol-1-amine. Following Lipinski's Rule of Five, 4-nitro-1H-pyrazol-1-amine 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
Frequently Asked Questions
What is the CAS number of 4-nitro-1H-pyrazol-1-amine?
The CAS number of 4-nitro-1H-pyrazol-1-amine is 3994-40-9.
What is the molecular formula of 4-nitro-1H-pyrazol-1-amine?
The molecular formula of 4-nitro-1H-pyrazol-1-amine is C3H4N4O2.
What is the molecular weight of 4-nitro-1H-pyrazol-1-amine?
The molecular weight of 4-nitro-1H-pyrazol-1-amine is 128.03 g/mol.
Where can I buy 4-nitro-1H-pyrazol-1-amine?
You can request a quote for 4-nitro-1H-pyrazol-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-1H-pyrazol-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-1H-pyrazol-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.