![4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine structure](/static/products/861/861881-07-4.png)
4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine
TL;DR: 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine (CAS 861881-07-4) is a chemical compound with molecular formula C11H11F3N2O2S and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-nitro-4-(trifluoromethyl)phenyl]thiomorpholine
Also Known As: Maybridge1_007405, 4-[2-nitro-4-(trifluoromethyl)phenyl]thiomorpholine, Thiomorpholine, 4-[2-nitro-4-(trifluoromethyl)phenyl]-, 4-(2-nitro-4-(trifluoromethyl)phenyl)thiomorpholine
| Molecular Formula | C11H11F3N2O2S |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 3.1668 |
| Topological Polar Surface Area | 46.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.04935 |
| Heavy Atoms | 19 |
| Complexity | 487.3189 |
Chemical Identifiers
| CAS Number | 861881-07-4 |
|---|---|
| SMILES | C1CSCCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine (CAS 861881-07-4), with molecular formula C11H11F3N2O2S and molecular weight 292.05 g/mol. IUPAC: 4-[2-nitro-4-(trifluoromethyl)phenyl]thiomorpholine.
Chemical Property Profile of 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine
Property Insights of 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine
The XLogP value of 3.1668 indicates that 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.38 Ų, 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine has 0 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 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine?
The CAS number of 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine is 861881-07-4.
What is the molecular formula of 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine?
The molecular formula of 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine is C11H11F3N2O2S.
What is the molecular weight of 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine?
The molecular weight of 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine is 292.05 g/mol.
Where can I buy 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine?
You can request a quote for 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-Nitro-4-(trifluoromethyl)phenyl]thiomorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.