Dinitroethylene diamine
TL;DR: Dinitroethylene diamine (CAS 505-71-5) is a chemical compound with molecular formula C2H6N4O4 and molecular weight 150.03891 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-nitramidoethyl)nitramide
Also Known As: Haleite, Ethylenedinitramine, Ethylenedinitroamine, N,N'-Dinitroethylenediamine, Dinitroethylene diamine
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C2H6N4O4 |
| Molecular Weight | 150.03891 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.03891 Da |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
| SMILES | C(CN[N+](=O)[O-])N[N+](=O)[O-] |
| InChIKey | QCOXCILKVHKOGO-UHFFFAOYSA-N |
Product Description
Applications: Dinitroethylene diamine is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dinitroethylene diamine (CAS 505-71-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Dinitroethylene diamine is a heterocyclic building block identified by CAS number 505-71-5 and the molecular formula C2H6N4O4 and a molecular weight of 150.04 g/mol. It is also known as Haleite and Ethylenedinitramine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Dinitroethylene diamine
Property Insights of Dinitroethylene diamine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dinitroethylene diamine. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dinitroethylene diamine. Following Lipinski's Rule of Five, Dinitroethylene diamine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dinitroethylene diamine?
The CAS number of Dinitroethylene diamine is 505-71-5.
What is the molecular formula of Dinitroethylene diamine?
The molecular formula of Dinitroethylene diamine is C2H6N4O4.
What is the molecular weight of Dinitroethylene diamine?
The molecular weight of Dinitroethylene diamine is 150.03891 g/mol.
What are the applications of Dinitroethylene diamine?
Dinitroethylene diamine is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy Dinitroethylene diamine?
You can request a quote for Dinitroethylene diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dinitroethylene diamine?
Yes, CoreyChem provides custom synthesis services for Dinitroethylene diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.