Cyanogen,di-N-oxide
TL;DR: Cyanogen,di-N-oxide (CAS 4331-98-0) is a chemical compound with molecular formula C2N2O2 and molecular weight 84.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dinitrosoethyne
Also Known As: Cyanogen,di-N-oxide, Dinitrosoethyne, dinitroso-acetylene, cyanogen-di-N-oxide, Ethanedinitrile oxide
| Molecular Formula | C2N2O2 |
|---|---|
| Molecular Weight | 84.00 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 83.99598 |
| Heavy Atoms | 6 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 4331-98-0 |
|---|---|
| SMILES | C(#CN=O)N=O |
| InChIKey | ODQXLDVTNSMSNA-UHFFFAOYSA-N |
Product Overview
Cyanogen,di-N-oxide (CAS 4331-98-0), with molecular formula C2N2O2 and molecular weight 84.00 g/mol. IUPAC: 1,2-dinitrosoethyne.
Chemical Property Profile of Cyanogen,di-N-oxide
Property Insights of Cyanogen,di-N-oxide
The XLogP value of -0.2 indicates that Cyanogen,di-N-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.9 Ų, Cyanogen,di-N-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyanogen,di-N-oxide has 0 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 Cyanogen,di-N-oxide?
The CAS number of Cyanogen,di-N-oxide is 4331-98-0.
What is the molecular formula of Cyanogen,di-N-oxide?
The molecular formula of Cyanogen,di-N-oxide is C2N2O2.
What is the molecular weight of Cyanogen,di-N-oxide?
The molecular weight of Cyanogen,di-N-oxide is 84.00 g/mol.
Where can I buy Cyanogen,di-N-oxide?
You can request a quote for Cyanogen,di-N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyanogen,di-N-oxide?
Yes, KEHONG BIO provides custom synthesis services for Cyanogen,di-N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.