二硝基乙二胺
TL;DR: 二硝基乙二胺 (CAS 505-71-5) is a chemical compound with molecular formula C2H6N4O4 and molecular weight 150.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二硝基乙二胺
N-(2-nitramidoethyl)nitramide
Also Known As: Haleite, Ethylenedinitramine, Ethylenedinitroamine, N,N'-Dinitroethylenediamine, Dinitroethylene diamine
| Molecular Formula | C2H6N4O4 |
|---|---|
| Molecular Weight | 150.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.03891 |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 505-71-5 |
|---|---|
| SMILES | C(CN[N+](=O)[O-])N[N+](=O)[O-] |
| InChIKey | QCOXCILKVHKOGO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二硝基乙二胺 (CAS 505-71-5), with molecular formula C2H6N4O4 and molecular weight 150.04 g/mol. IUPAC: N-(2-nitramidoethyl)nitramide.
Chemical Property Profile of 二硝基乙二胺
Property Insights of 二硝基乙二胺
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二硝基乙二胺. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 二硝基乙二胺. Following Lipinski's Rule of Five, 二硝基乙二胺 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
Frequently Asked Questions
What is the CAS number of 二硝基乙二胺?
The CAS number of 二硝基乙二胺 is 505-71-5.
What is the molecular formula of 二硝基乙二胺?
The molecular formula of 二硝基乙二胺 is C2H6N4O4.
What is the molecular weight of 二硝基乙二胺?
The molecular weight of 二硝基乙二胺 is 150.04 g/mol.
Where can I buy 二硝基乙二胺?
You can request a quote for 二硝基乙二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二硝基乙二胺?
Yes, KEHONG BIO provides custom synthesis services for 二硝基乙二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.