2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-
TL;DR: 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)- (CAS 127183-51-1) is a chemical compound with molecular formula C7H7F3N2OS and molecular weight 224.02312 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,1-trifluoro-3-(1-methylimidazol-2-yl)sulfanylpropan-2-one
Also Known As: 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-, 1,1,1-trifluoro-3-(1-methylimidazol-2-yl)sulfanylpropan-2-one, 1,1,1-trifluoro-3-(1-methylimidazol-2-yl)sulfanyl-propan-2-one, 1,1,1-Trifluoro-3-[(1-methyl-1H-imidazol-2-yl)sulfanyl]propan-2-one
Technical Specifications
| Molecular Formula | C7H7F3N2OS |
| Molecular Weight | 224.02312 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 60.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.02312 Da |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
| SMILES | CN1C=CN=C1SCC(=O)C(F)(F)F |
| InChIKey | RKMRGJANBQKPQW-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-
Property Insights of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-. Following Lipinski's Rule of Five, 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-?
The CAS number of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)- is 127183-51-1.
What is the molecular formula of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-?
The molecular formula of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)- is C7H7F3N2OS.
What is the molecular weight of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-?
The molecular weight of 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)- is 224.02312 g/mol.
Where can I buy 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-?
You can request a quote for 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)-?
Yes, CoreyChem provides custom synthesis services for 2-Propanone, 1,1,1-trifluoro-3-((1-methyl-1H-imidazol-2-yl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.