Trifluoromethanesulfonyl chloride
TL;DR: Trifluoromethanesulfonyl chloride (CAS 421-83-0) is a chemical compound with molecular formula CClF3O2S and molecular weight 167.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trifluoromethanesulfonyl chloride
Also Known As: Trifluoromethanesulfonyl chloride, Triflyl chloride, triflic chloride, Trifluoromethanesulphonyl chloride, CClF3O2S
| Molecular Formula | CClF3O2S |
|---|---|
| Molecular Weight | 167.93 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.92596 |
| Heavy Atoms | 8 |
| Complexity | 161.0 |
| Vapor Pressure | 535.6 [mmHg] |
Chemical Identifiers
| CAS Number | 421-83-0 |
|---|---|
| SMILES | C(F)(F)(F)S(=O)(=O)Cl |
| InChIKey | GRGCWBWNLSTIEN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trifluoromethanesulfonyl chloride (CAS 421-83-0), with molecular formula CClF3O2S and molecular weight 167.93 g/mol. IUPAC: trifluoromethanesulfonyl chloride.
Chemical Property Profile of Trifluoromethanesulfonyl chloride
Property Insights of Trifluoromethanesulfonyl chloride
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trifluoromethanesulfonyl chloride. With a topological polar surface area (TPSA) of 42.5 Ų, Trifluoromethanesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trifluoromethanesulfonyl chloride has 0 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 Trifluoromethanesulfonyl chloride?
The CAS number of Trifluoromethanesulfonyl chloride is 421-83-0.
What is the molecular formula of Trifluoromethanesulfonyl chloride?
The molecular formula of Trifluoromethanesulfonyl chloride is CClF3O2S.
What is the molecular weight of Trifluoromethanesulfonyl chloride?
The molecular weight of Trifluoromethanesulfonyl chloride is 167.93 g/mol.
Where can I buy Trifluoromethanesulfonyl chloride?
You can request a quote for Trifluoromethanesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trifluoromethanesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for Trifluoromethanesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.