1,2,5-Oxadiazole-3,4-dicarbonitrile
TL;DR: 1,2,5-Oxadiazole-3,4-dicarbonitrile (CAS 55644-07-0) is a chemical compound with molecular formula C4N4O and molecular weight 120.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,5-oxadiazole-3,4-dicarbonitrile
Also Known As: 1,2,5-oxadiazole-3,4-dicarbonitrile, 3,4-Dicyanofurazan, DICYANOFURAZAN, Furazandicarbonitrile, furazan-3,4-dicarbonitrile
| Molecular Formula | C4N4O |
|---|---|
| Molecular Weight | 120.01 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 86.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 120.00721 |
| Heavy Atoms | 9 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 55644-07-0 |
|---|---|
| SMILES | C(#N)C1=NON=C1C#N |
| InChIKey | BTZCEZGZARPAIA-UHFFFAOYSA-N |
Product Overview
1,2,5-Oxadiazole-3,4-dicarbonitrile (CAS 55644-07-0), with molecular formula C4N4O and molecular weight 120.01 g/mol. IUPAC: 1,2,5-oxadiazole-3,4-dicarbonitrile.
Chemical Property Profile of 1,2,5-Oxadiazole-3,4-dicarbonitrile
Property Insights of 1,2,5-Oxadiazole-3,4-dicarbonitrile
The XLogP value of -0.1 indicates that 1,2,5-Oxadiazole-3,4-dicarbonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,5-Oxadiazole-3,4-dicarbonitrile. Following Lipinski's Rule of Five, 1,2,5-Oxadiazole-3,4-dicarbonitrile has 0 hydrogen bond donor(s) and 5 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 1,2,5-Oxadiazole-3,4-dicarbonitrile?
The CAS number of 1,2,5-Oxadiazole-3,4-dicarbonitrile is 55644-07-0.
What is the molecular formula of 1,2,5-Oxadiazole-3,4-dicarbonitrile?
The molecular formula of 1,2,5-Oxadiazole-3,4-dicarbonitrile is C4N4O.
What is the molecular weight of 1,2,5-Oxadiazole-3,4-dicarbonitrile?
The molecular weight of 1,2,5-Oxadiazole-3,4-dicarbonitrile is 120.01 g/mol.
Where can I buy 1,2,5-Oxadiazole-3,4-dicarbonitrile?
You can request a quote for 1,2,5-Oxadiazole-3,4-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,5-Oxadiazole-3,4-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1,2,5-Oxadiazole-3,4-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.