2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride
TL;DR: 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride (CAS 4274-38-8) is a chemical compound with molecular formula C7H7ClF3NS and molecular weight 228.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(trifluoromethyl)benzenethiol;hydrochloride
Also Known As: 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride, 3-Amino-4-mercaptobenzotrifluoride hydrochloride, 3-Amino-4-mercaptobenzotrifluoride HCl, C(F)(F)(F)c1ccc(S)c(N)c1, 2-amino-4-(trifluoromethyl)benzenethiol;hydrochloride
| Molecular Formula | C7H7ClF3NS |
|---|---|
| Molecular Weight | 228.99 g/mol |
| LogP | 2.9981 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.99399 |
| Heavy Atoms | 13 |
| Complexity | 300.2794 |
Chemical Identifiers
| CAS Number | 4274-38-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)N)S.Cl |
Product Overview
2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride (CAS 4274-38-8), with molecular formula C7H7ClF3NS and molecular weight 228.99 g/mol. IUPAC: 2-amino-4-(trifluoromethyl)benzenethiol;hydrochloride.
Chemical Property Profile of 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride
Property Insights of 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride
The XLogP value of 2.9981 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride. With a topological polar surface area (TPSA) of 26.02 Ų, 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride has 2 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 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride?
The CAS number of 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride is 4274-38-8.
What is the molecular formula of 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride?
The molecular formula of 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride is C7H7ClF3NS.
What is the molecular weight of 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride?
The molecular weight of 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride is 228.99 g/mol.
Where can I buy 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride?
You can request a quote for 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.