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5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline
TL;DR: 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline (CAS 346694-29-9) is a chemical compound with molecular formula C10H10ClF3N2O3 and molecular weight 298.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline
Also Known As: 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline, AB00093133-01
| Molecular Formula | C10H10ClF3N2O3 |
|---|---|
| Molecular Weight | 298.03 g/mol |
| LogP | 3.239 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.0332 |
| Heavy Atoms | 19 |
| Complexity | 454.1363 |
Chemical Identifiers
| CAS Number | 346694-29-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)NCCOCC(F)(F)F)[N+](=O)[O-] |
Product Overview
5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline (CAS 346694-29-9), with molecular formula C10H10ClF3N2O3 and molecular weight 298.03 g/mol. IUPAC: 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline.
Chemical Property Profile of 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline
Property Insights of 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline
The XLogP value of 3.239 indicates that 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline. Following Lipinski's Rule of Five, 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline has 1 hydrogen bond donor(s) and 4 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 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline?
The CAS number of 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline is 346694-29-9.
What is the molecular formula of 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline?
The molecular formula of 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline is C10H10ClF3N2O3.
What is the molecular weight of 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline?
The molecular weight of 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline is 298.03 g/mol.
Where can I buy 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline?
You can request a quote for 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-2-nitro-N-[2-(2,2,2-trifluoroethoxy)ethyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.