4-((Trifluoromethyl)sulfinyl)aniline
TL;DR: 4-((Trifluoromethyl)sulfinyl)aniline (CAS 708-67-8) is a chemical compound with molecular formula C7H6F3NOS and molecular weight 209.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(trifluoromethylsulfinyl)aniline
Also Known As: Benzenamine, 4-[(trifluoromethyl)sulfinyl]-, 4-(trifluoromethylsulfinyl)aniline, 4-trifluoromethanesulfinylaniline, 4-((Trifluoromethyl)sulfinyl)aniline, 4-(trifluoromethane)sulfinylaniline
| Molecular Formula | C7H6F3NOS |
|---|---|
| Molecular Weight | 209.01 g/mol |
| LogP | 1.8962 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.01222 |
| Heavy Atoms | 13 |
| Complexity | 319.5047 |
Chemical Identifiers
| CAS Number | 708-67-8 |
|---|---|
| SMILES | C1=CC(=CC=C1N)S(=O)C(F)(F)F |
Product Overview
4-((Trifluoromethyl)sulfinyl)aniline (CAS 708-67-8), with molecular formula C7H6F3NOS and molecular weight 209.01 g/mol. IUPAC: 4-(trifluoromethylsulfinyl)aniline.
Chemical Property Profile of 4-((Trifluoromethyl)sulfinyl)aniline
Property Insights of 4-((Trifluoromethyl)sulfinyl)aniline
The XLogP value of 1.8962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((Trifluoromethyl)sulfinyl)aniline. With a topological polar surface area (TPSA) of 43.09 Ų, 4-((Trifluoromethyl)sulfinyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((Trifluoromethyl)sulfinyl)aniline has 1 hydrogen bond donor(s) and 2 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-((Trifluoromethyl)sulfinyl)aniline?
The CAS number of 4-((Trifluoromethyl)sulfinyl)aniline is 708-67-8.
What is the molecular formula of 4-((Trifluoromethyl)sulfinyl)aniline?
The molecular formula of 4-((Trifluoromethyl)sulfinyl)aniline is C7H6F3NOS.
What is the molecular weight of 4-((Trifluoromethyl)sulfinyl)aniline?
The molecular weight of 4-((Trifluoromethyl)sulfinyl)aniline is 209.01 g/mol.
Where can I buy 4-((Trifluoromethyl)sulfinyl)aniline?
You can request a quote for 4-((Trifluoromethyl)sulfinyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((Trifluoromethyl)sulfinyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-((Trifluoromethyl)sulfinyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.