Antipyrinyl-4-peroxide
TL;DR: Antipyrinyl-4-peroxide (CAS 69124-27-2) is a chemical compound with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroperoxy-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: Antipyrinyl-4-peroxide, Antipyrine-4-Peroxide, 4-hydroperoxy-1,5-dimethyl-2-phenylpyrazol-3-one, 4-Hydroperoxy-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one, 3H-Pyrazol-3-one, 1,2-dihydro-4-hydroperoxy-1,5-dimethyl-2-phenyl-
| Molecular Formula | C11H12N2O3 |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.0848 |
| Heavy Atoms | 16 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 69124-27-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)OO |
| InChIKey | PRHVTMZSBSBTNG-UHFFFAOYSA-N |
Product Overview
Antipyrinyl-4-peroxide (CAS 69124-27-2), with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol. IUPAC: 4-hydroperoxy-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of Antipyrinyl-4-peroxide
Property Insights of Antipyrinyl-4-peroxide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antipyrinyl-4-peroxide. With a topological polar surface area (TPSA) of 53.0 Ų, Antipyrinyl-4-peroxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Antipyrinyl-4-peroxide 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 Antipyrinyl-4-peroxide?
The CAS number of Antipyrinyl-4-peroxide is 69124-27-2.
What is the molecular formula of Antipyrinyl-4-peroxide?
The molecular formula of Antipyrinyl-4-peroxide is C11H12N2O3.
What is the molecular weight of Antipyrinyl-4-peroxide?
The molecular weight of Antipyrinyl-4-peroxide is 220.08 g/mol.
Where can I buy Antipyrinyl-4-peroxide?
You can request a quote for Antipyrinyl-4-peroxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antipyrinyl-4-peroxide?
Yes, KEHONG BIO provides custom synthesis services for Antipyrinyl-4-peroxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.