3,5-ditert-butyl-4-nitroso-1H-pyrazole
TL;DR: 3,5-ditert-butyl-4-nitroso-1H-pyrazole (CAS 38749-07-4) is a chemical compound with molecular formula C11H19N3O and molecular weight 209.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-ditert-butyl-4-nitroso-1H-pyrazole
Also Known As: 3,5-ditert-butyl-4-nitroso-1H-pyrazole, 3,5-Di-t-butyl-4-nitrosopyrazol, 3,5-Di-tert-butyl-4-nitroso-1H-pyrazole, 3,5-Ditert-butyl-4-(oxoamino)-1H-pyrazole, 1H-Pyrazole, 3,5-bis(1,1-dimethylethyl)-4-nitroso-
| Molecular Formula | C11H19N3O |
|---|---|
| Molecular Weight | 209.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.15282 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 38749-07-4 |
|---|---|
| SMILES | CC(C)(C)C1=C(C(=NN1)C(C)(C)C)N=O |
| InChIKey | KXOMVLWPRCSEIC-UHFFFAOYSA-N |
Product Overview
3,5-ditert-butyl-4-nitroso-1H-pyrazole (CAS 38749-07-4), with molecular formula C11H19N3O and molecular weight 209.15 g/mol. IUPAC: 3,5-ditert-butyl-4-nitroso-1H-pyrazole.
Chemical Property Profile of 3,5-ditert-butyl-4-nitroso-1H-pyrazole
Property Insights of 3,5-ditert-butyl-4-nitroso-1H-pyrazole
The XLogP value of 3.0 indicates that 3,5-ditert-butyl-4-nitroso-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, 3,5-ditert-butyl-4-nitroso-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-ditert-butyl-4-nitroso-1H-pyrazole has 1 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 3,5-ditert-butyl-4-nitroso-1H-pyrazole?
The CAS number of 3,5-ditert-butyl-4-nitroso-1H-pyrazole is 38749-07-4.
What is the molecular formula of 3,5-ditert-butyl-4-nitroso-1H-pyrazole?
The molecular formula of 3,5-ditert-butyl-4-nitroso-1H-pyrazole is C11H19N3O.
What is the molecular weight of 3,5-ditert-butyl-4-nitroso-1H-pyrazole?
The molecular weight of 3,5-ditert-butyl-4-nitroso-1H-pyrazole is 209.15 g/mol.
Where can I buy 3,5-ditert-butyl-4-nitroso-1H-pyrazole?
You can request a quote for 3,5-ditert-butyl-4-nitroso-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-ditert-butyl-4-nitroso-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3,5-ditert-butyl-4-nitroso-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.