2-氨基-4-(三氟甲基)苯硫酚
TL;DR: 2-氨基-4-(三氟甲基)苯硫酚 (CAS 19406-49-6) is a chemical compound with molecular formula C7H6F3NS and molecular weight 193.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基-4-(三氟甲基)苯硫酚
2-amino-4-(trifluoromethyl)benzenethiol
Also Known As: 2-Amino-4-(trifluoromethyl)benzenethiol, 2-Amino-4-(trifluoromethyl)thiophenol, 2-amino-4-(trifluoromethyl)benzene-1-thiol, 3-Amino-4-mercaptobenzotrifluoride, 4-Methoxy-1-naphthaldehyde
| Molecular Formula | C7H6F3NS |
|---|---|
| Molecular Weight | 193.02 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 193.0173 |
| Heavy Atoms | 12 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 19406-49-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)N)S |
| InChIKey | MVTRQRSNYWDWMY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氨基-4-(三氟甲基)苯硫酚 (CAS 19406-49-6), with molecular formula C7H6F3NS and molecular weight 193.02 g/mol. IUPAC: 2-amino-4-(trifluoromethyl)benzenethiol.
Chemical Property Profile of 2-氨基-4-(三氟甲基)苯硫酚
Property Insights of 2-氨基-4-(三氟甲基)苯硫酚
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氨基-4-(三氟甲基)苯硫酚. With a topological polar surface area (TPSA) of 27.0 Ų, 2-氨基-4-(三氟甲基)苯硫酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氨基-4-(三氟甲基)苯硫酚 has 2 hydrogen bond donor(s) and 5 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-氨基-4-(三氟甲基)苯硫酚?
The CAS number of 2-氨基-4-(三氟甲基)苯硫酚 is 19406-49-6.
What is the molecular formula of 2-氨基-4-(三氟甲基)苯硫酚?
The molecular formula of 2-氨基-4-(三氟甲基)苯硫酚 is C7H6F3NS.
What is the molecular weight of 2-氨基-4-(三氟甲基)苯硫酚?
The molecular weight of 2-氨基-4-(三氟甲基)苯硫酚 is 193.02 g/mol.
Where can I buy 2-氨基-4-(三氟甲基)苯硫酚?
You can request a quote for 2-氨基-4-(三氟甲基)苯硫酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基-4-(三氟甲基)苯硫酚?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基-4-(三氟甲基)苯硫酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.