1,4-Benzoquinone dioxime
TL;DR: 1,4-Benzoquinone dioxime (CAS 105-11-3) is a chemical compound with molecular formula C6H6N2O2 and molecular weight 138.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-nitrosophenyl)hydroxylamine
Also Known As: 1,4-Benzoquinone dioxime, p-Benzoquinonedioxime, p-Quinone dioxime, Quinone dioxime, P-BENZOQUINONE DIOXIME
| Molecular Formula | C6H6N2O2 |
|---|---|
| Molecular Weight | 138.04 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 61.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.04292 |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 105-11-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NO)N=O |
| InChIKey | DZCCLNYLUGNUKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Benzoquinone dioxime (CAS 105-11-3), with molecular formula C6H6N2O2 and molecular weight 138.04 g/mol. IUPAC: N-(4-nitrosophenyl)hydroxylamine.
Chemical Property Profile of 1,4-Benzoquinone dioxime
Property Insights of 1,4-Benzoquinone dioxime
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Benzoquinone dioxime. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Benzoquinone dioxime. Following Lipinski's Rule of Five, 1,4-Benzoquinone dioxime has 2 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 1,4-Benzoquinone dioxime?
The CAS number of 1,4-Benzoquinone dioxime is 105-11-3.
What is the molecular formula of 1,4-Benzoquinone dioxime?
The molecular formula of 1,4-Benzoquinone dioxime is C6H6N2O2.
What is the molecular weight of 1,4-Benzoquinone dioxime?
The molecular weight of 1,4-Benzoquinone dioxime is 138.04 g/mol.
Where can I buy 1,4-Benzoquinone dioxime?
You can request a quote for 1,4-Benzoquinone dioxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzoquinone dioxime?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzoquinone dioxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.