Pyrazole aldoxime
TL;DR: Pyrazole aldoxime (CAS 30192-58-6) is a chemical compound with molecular formula C4H5N3O and molecular weight 111.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-pyrazol-5-ylmethylidene)hydroxylamine
Also Known As: pyrazole aldoxime, 1H-pyrazole-3-carboxaldehyde oxime, 1H-Pyrazole-3-carboxaldehyde,oxime(9ci), 1H-Pyrazole-3-carboxaldehyde, oxime (9CI)
| Molecular Formula | C4H5N3O |
|---|---|
| Molecular Weight | 111.04 g/mol |
| LogP | 0.2178 |
| Topological Polar Surface Area | 61.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 111.04326 |
| Heavy Atoms | 8 |
| Complexity | 167.41891 |
Chemical Identifiers
| CAS Number | 30192-58-6 |
|---|---|
| SMILES | C1=C(NN=C1)C=NO |
Product Overview
Pyrazole aldoxime (CAS 30192-58-6), with molecular formula C4H5N3O and molecular weight 111.04 g/mol. IUPAC: N-(1H-pyrazol-5-ylmethylidene)hydroxylamine.
Chemical Property Profile of Pyrazole aldoxime
Property Insights of Pyrazole aldoxime
The XLogP value of 0.2178 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazole aldoxime. The TPSA of 61.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazole aldoxime. Following Lipinski's Rule of Five, Pyrazole aldoxime has 2 hydrogen bond donor(s) and 3 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 Pyrazole aldoxime?
The CAS number of Pyrazole aldoxime is 30192-58-6.
What is the molecular formula of Pyrazole aldoxime?
The molecular formula of Pyrazole aldoxime is C4H5N3O.
What is the molecular weight of Pyrazole aldoxime?
The molecular weight of Pyrazole aldoxime is 111.04 g/mol.
Where can I buy Pyrazole aldoxime?
You can request a quote for Pyrazole aldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazole aldoxime?
Yes, KEHONG BIO provides custom synthesis services for Pyrazole aldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.