3-Amino-1,1,1-trifluoropropane-2-thiol
TL;DR: 3-Amino-1,1,1-trifluoropropane-2-thiol (CAS 186791-26-4) is a chemical compound with molecular formula C3H6F3NS and molecular weight 145.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-1,1,1-trifluoropropane-2-thiol
Also Known As: 3-amino-1,1,1-trifluoropropane-2-thiol, 2-mercapto-3,3,3-trifluoropropylamine, 3-amino-1,1,1-trifluoro-propane-2-thiol, 2-Propanethiol, 3-amino-1,1,1-trifluoro-, 2,2'-Bi-1,3,2-benzodioxaborole,5,5'-dimethyl
| Molecular Formula | C3H6F3NS |
|---|---|
| Molecular Weight | 145.02 g/mol |
| LogP | 0.8058 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.0173 |
| Heavy Atoms | 8 |
| Complexity | 71.419014 |
Chemical Identifiers
| CAS Number | 186791-26-4 |
|---|---|
| SMILES | C(C(C(F)(F)F)S)N |
Product Overview
3-Amino-1,1,1-trifluoropropane-2-thiol (CAS 186791-26-4), with molecular formula C3H6F3NS and molecular weight 145.02 g/mol. IUPAC: 3-amino-1,1,1-trifluoropropane-2-thiol.
Chemical Property Profile of 3-Amino-1,1,1-trifluoropropane-2-thiol
Property Insights of 3-Amino-1,1,1-trifluoropropane-2-thiol
The XLogP value of 0.8058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-1,1,1-trifluoropropane-2-thiol. With a topological polar surface area (TPSA) of 26.02 Ų, 3-Amino-1,1,1-trifluoropropane-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-1,1,1-trifluoropropane-2-thiol 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 3-Amino-1,1,1-trifluoropropane-2-thiol?
The CAS number of 3-Amino-1,1,1-trifluoropropane-2-thiol is 186791-26-4.
What is the molecular formula of 3-Amino-1,1,1-trifluoropropane-2-thiol?
The molecular formula of 3-Amino-1,1,1-trifluoropropane-2-thiol is C3H6F3NS.
What is the molecular weight of 3-Amino-1,1,1-trifluoropropane-2-thiol?
The molecular weight of 3-Amino-1,1,1-trifluoropropane-2-thiol is 145.02 g/mol.
Where can I buy 3-Amino-1,1,1-trifluoropropane-2-thiol?
You can request a quote for 3-Amino-1,1,1-trifluoropropane-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-1,1,1-trifluoropropane-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-1,1,1-trifluoropropane-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.