n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine
TL;DR: n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine (CAS 5431-36-7) is a chemical compound with molecular formula C14H14N4O4 and molecular weight 302.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-bis(4-nitrophenyl)ethane-1,2-diamine
Also Known As: Hydro-4-nitro-benzamid, di(4-nitrophenyl)ethylenediamine, 4.4'.4''-Trinitrohydrobenzamid, n,n'-bis(4-nitrophenyl)ethane-1,2-diamine, 4-nitro-N-{2-[(4-nitrophenyl)amino]ethyl}aniline
| Molecular Formula | C14H14N4O4 |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.1015 |
| Heavy Atoms | 22 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 5431-36-7 |
|---|---|
| SMILES | C1=CC(=CC=C1NCCNC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | HTOLGGNSOCNPBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine (CAS 5431-36-7), with molecular formula C14H14N4O4 and molecular weight 302.10 g/mol. IUPAC: N,N'-bis(4-nitrophenyl)ethane-1,2-diamine.
Chemical Property Profile of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine
Property Insights of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine
The XLogP value of 3.2 indicates that n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine. Following Lipinski's Rule of Five, n,n'-Bis(4-nitrophenyl)ethane-1,2-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
Frequently Asked Questions
What is the CAS number of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine?
The CAS number of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine is 5431-36-7.
What is the molecular formula of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine?
The molecular formula of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine is C14H14N4O4.
What is the molecular weight of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine?
The molecular weight of n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine is 302.10 g/mol.
Where can I buy n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine?
You can request a quote for n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for n,n'-Bis(4-nitrophenyl)ethane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.