![2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride structure](/static/products/885/885461-00-7.png)
2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride
TL;DR: 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride (CAS 885461-00-7) is a chemical compound with molecular formula C4H3Cl2F3OS and molecular weight 225.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-chloro-2,2,2-trifluoroethyl)sulfanylacetyl chloride
Also Known As: 2-[(1-chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride, [(1-chloro-2,2,2-trifluoroethyl)thio]acetyl chloride, 2-(1-chloro-2,2,2-trifluoroethyl)sulfanylacetyl chloride, 2-[(1-chloro-2,2,2-trifluoroethyl)sulfanyl]acetylchloride
| Molecular Formula | C4H3Cl2F3OS |
|---|---|
| Molecular Weight | 225.92 g/mol |
| LogP | 2.6122 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.92337 |
| Heavy Atoms | 11 |
| Complexity | 148.76282 |
Chemical Identifiers
| CAS Number | 885461-00-7 |
|---|---|
| SMILES | C(C(=O)Cl)SC(C(F)(F)F)Cl |
Product Overview
2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride (CAS 885461-00-7), with molecular formula C4H3Cl2F3OS and molecular weight 225.92 g/mol. IUPAC: 2-(1-chloro-2,2,2-trifluoroethyl)sulfanylacetyl chloride.
Chemical Property Profile of 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride
Property Insights of 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride
The XLogP value of 2.6122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride. With a topological polar surface area (TPSA) of 17.07 Ų, 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride has 0 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-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride?
The CAS number of 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride is 885461-00-7.
What is the molecular formula of 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride?
The molecular formula of 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride is C4H3Cl2F3OS.
What is the molecular weight of 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride?
The molecular weight of 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride is 225.92 g/mol.
Where can I buy 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride?
You can request a quote for 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1-Chloro-2,2,2-trifluoroethyl)sulfanyl]acetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.