![1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene structure](/static/products/5619/56191-32-3.webp)
1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene
TL;DR: 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene (CAS 56191-32-3) is a chemical compound with molecular formula C14H10F3NO4S and molecular weight 345.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylsulfinylphenoxy)-2-nitro-4-(trifluoromethyl)benzene
Also Known As: 1-[4-(methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene, 1-(4-methylsulfinylphenoxy)-2-nitro-4-(trifluoromethyl)benzene, 1-[4-(Methanesulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene
| Molecular Formula | C14H10F3NO4S |
|---|---|
| Molecular Weight | 345.03 g/mol |
| LogP | 4.1433 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.02826 |
| Heavy Atoms | 23 |
| Complexity | 759.608 |
Chemical Identifiers
| CAS Number | 56191-32-3 |
|---|---|
| SMILES | CS(=O)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene (CAS 56191-32-3), with molecular formula C14H10F3NO4S and molecular weight 345.03 g/mol. IUPAC: 1-(4-methylsulfinylphenoxy)-2-nitro-4-(trifluoromethyl)benzene.
Chemical Property Profile of 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene
Property Insights of 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene
The XLogP value of 4.1433 indicates that 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene. Following Lipinski's Rule of Five, 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene 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 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene?
The CAS number of 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene is 56191-32-3.
What is the molecular formula of 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene?
The molecular formula of 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene is C14H10F3NO4S.
What is the molecular weight of 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene?
The molecular weight of 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene is 345.03 g/mol.
Where can I buy 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene?
You can request a quote for 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Methylsulfinyl)phenoxy]-2-nitro-4-(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.