N-Ethyl-N,2,4,6-tetranitroaniline
TL;DR: N-Ethyl-N,2,4,6-tetranitroaniline (CAS 6052-13-7) is a chemical compound with molecular formula C8H7N5O8 and molecular weight 301.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-(2,4,6-trinitrophenyl)nitramide
Also Known As: Tetrethyl, Ethyl tetryl, Ethyl-tetryl, N-Ethyl-N,2,4,6-tetranitroaniline, Trinitrophenylethylnitramine
| Molecular Formula | C8H7N5O8 |
|---|---|
| Molecular Weight | 301.03 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 187.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.02945 |
| Heavy Atoms | 21 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 6052-13-7 |
|---|---|
| SMILES | CCN(C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | AWOPOGMEMRZDQH-UHFFFAOYSA-N |
Product Overview
N-Ethyl-N,2,4,6-tetranitroaniline (CAS 6052-13-7), with molecular formula C8H7N5O8 and molecular weight 301.03 g/mol. IUPAC: N-ethyl-N-(2,4,6-trinitrophenyl)nitramide.
Chemical Property Profile of N-Ethyl-N,2,4,6-tetranitroaniline
Property Insights of N-Ethyl-N,2,4,6-tetranitroaniline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Ethyl-N,2,4,6-tetranitroaniline. The TPSA of 187.0 Ų indicates high polarity, suggesting N-Ethyl-N,2,4,6-tetranitroaniline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Ethyl-N,2,4,6-tetranitroaniline has 0 hydrogen bond donor(s) and 9 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-Ethyl-N,2,4,6-tetranitroaniline?
The CAS number of N-Ethyl-N,2,4,6-tetranitroaniline is 6052-13-7.
What is the molecular formula of N-Ethyl-N,2,4,6-tetranitroaniline?
The molecular formula of N-Ethyl-N,2,4,6-tetranitroaniline is C8H7N5O8.
What is the molecular weight of N-Ethyl-N,2,4,6-tetranitroaniline?
The molecular weight of N-Ethyl-N,2,4,6-tetranitroaniline is 301.03 g/mol.
Where can I buy N-Ethyl-N,2,4,6-tetranitroaniline?
You can request a quote for N-Ethyl-N,2,4,6-tetranitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Ethyl-N,2,4,6-tetranitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-Ethyl-N,2,4,6-tetranitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.