![Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate structure](/static/products/7355/73553-87-4.webp)
Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate
TL;DR: Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate (CAS 73553-87-4) is a chemical compound with molecular formula C18H17F3N2O5 and molecular weight 398.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate
Also Known As: ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate, ethyl 2-{4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy}propanoate, ethyl 2-(4-{[2-nitro-4-(trifluoromethyl)phenyl]amino}phenoxy)propanoate, ethyl 2-(4-(2-nitro-4-(trifluoromethyl)phenylamino)phenoxy)propionate, ethyl2-(4-{[2-nitro-4-(trifluoromethyl)phenyl]amino}phenoxy)propanoate
| Molecular Formula | C18H17F3N2O5 |
|---|---|
| Molecular Weight | 398.11 g/mol |
| LogP | 4.6876 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.10895 |
| Heavy Atoms | 28 |
| Complexity | 853.28986 |
Chemical Identifiers
| CAS Number | 73553-87-4 |
|---|---|
| SMILES | CCOC(=O)C(C)OC1=CC=C(C=C1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate (CAS 73553-87-4), with molecular formula C18H17F3N2O5 and molecular weight 398.11 g/mol. IUPAC: ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate.
Chemical Property Profile of Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate
Property Insights of Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate
The XLogP value of 4.6876 indicates that Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate. Following Lipinski's Rule of Five, Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate 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 Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate?
The CAS number of Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate is 73553-87-4.
What is the molecular formula of Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate?
The molecular formula of Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate is C18H17F3N2O5.
What is the molecular weight of Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate?
The molecular weight of Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate is 398.11 g/mol.
Where can I buy Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate?
You can request a quote for Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[4-[2-nitro-4-(trifluoromethyl)anilino]phenoxy]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.