2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline
TL;DR: 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline (CAS 100280-33-9) is a chemical compound with molecular formula C10H11F4NS and molecular weight 253.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline
Also Known As: 2,3-dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline, 2,3-dimethyl-4-[(1,1,2,2-tetrafluoroethyl)sulfanyl]aniline, Benzenamine, 2,3-dimethyl-4-[(1,1,2,2-tetrafluoroethyl)thio]-?, Benzenamine, 4-[(2-chloro-1,1,2-trifluoroethyl)thio]-2,3-dimethyl-, Benzenamine, 5-chloro-2-methyl-4-[(1,1,2,2-tetrafluoroethyl)thio]-
| Molecular Formula | C10H11F4NS |
|---|---|
| Molecular Weight | 253.05 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.05484 |
| Heavy Atoms | 16 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 100280-33-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1C)SC(C(F)F)(F)F)N |
| InChIKey | PAIZRQUZWQHHFX-UHFFFAOYSA-N |
Product Overview
2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline (CAS 100280-33-9), with molecular formula C10H11F4NS and molecular weight 253.05 g/mol. IUPAC: 2,3-dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline.
Chemical Property Profile of 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline
Property Insights of 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline
The XLogP value of 4.1 indicates that 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.3 Ų, 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline 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 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline?
The CAS number of 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline is 100280-33-9.
What is the molecular formula of 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline?
The molecular formula of 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline is C10H11F4NS.
What is the molecular weight of 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline?
The molecular weight of 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline is 253.05 g/mol.
Where can I buy 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline?
You can request a quote for 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethyl-4-(1,1,2,2-tetrafluoroethylsulfanyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.