2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline
TL;DR: 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline (CAS 71094-06-9) is a chemical compound with molecular formula C8H5Cl3N4O4 and molecular weight 325.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline
Also Known As: 2,4-dinitro-N-[(E)-2,2,2-trichloroethylideneamino]aniline
| Molecular Formula | C8H5Cl3N4O4 |
|---|---|
| Molecular Weight | 325.94 g/mol |
| LogP | 3.2709 |
| Topological Polar Surface Area | 110.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.93765 |
| Heavy Atoms | 19 |
| Complexity | 543.2858 |
Chemical Identifiers
| CAS Number | 71094-06-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN=CC(Cl)(Cl)Cl |
Product Overview
2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline (CAS 71094-06-9), with molecular formula C8H5Cl3N4O4 and molecular weight 325.94 g/mol. IUPAC: 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline.
Chemical Property Profile of 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline
Property Insights of 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline
The XLogP value of 3.2709 indicates that 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline. Following Lipinski's Rule of Five, 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline has 1 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 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline?
The CAS number of 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline is 71094-06-9.
What is the molecular formula of 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline?
The molecular formula of 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline is C8H5Cl3N4O4.
What is the molecular weight of 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline?
The molecular weight of 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline is 325.94 g/mol.
Where can I buy 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline?
You can request a quote for 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dinitro-N-(2,2,2-trichloroethylideneamino)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.