Acetic acid, thio-, S-(2-fluoroethyl) ester
TL;DR: Acetic acid, thio-, S-(2-fluoroethyl) ester (CAS 462-31-7) is a chemical compound with molecular formula C4H7FOS and molecular weight 122.020164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-(2-fluoroethyl) ethanethioate
Also Known As: 2-Fluoroethyl thiolacetate, s-(2-fluoroethyl) ethanethioate, 1-(2-fluoroethylsulfanyl)ethanone, Ethanethioic S-acid, 2-fluoroethyl ester, Thioacetic acid S-(2-fluoroethyl) ester
Technical Specifications
| Molecular Formula | C4H7FOS |
| Molecular Weight | 122.020164 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 122.020164 Da |
| Heavy Atoms | 7 |
| Complexity | 64.0 |
| SMILES | CC(=O)SCCF |
| InChIKey | MFWYIFRPVITMEP-UHFFFAOYSA-N |
Product Description
Applications: Acetic acid, thio-, S-(2-fluoroethyl) ester is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Acetic acid, thio-, S-(2-fluoroethyl) ester (CAS 462-31-7) is a fine chemical with the molecular formula C4H7FOS and a molecular weight of 122.02 g/mol. Synonyms include 2-Fluoroethyl thiolacetate and s-(2-fluoroethyl) ethanethioate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Acetic acid, thio-, S-(2-fluoroethyl) ester
Property Insights of Acetic acid, thio-, S-(2-fluoroethyl) ester
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, thio-, S-(2-fluoroethyl) ester. With a topological polar surface area (TPSA) of 42.4 Ų, Acetic acid, thio-, S-(2-fluoroethyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, thio-, S-(2-fluoroethyl) ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, thio-, S-(2-fluoroethyl) ester?
The CAS number of Acetic acid, thio-, S-(2-fluoroethyl) ester is 462-31-7.
What is the molecular formula of Acetic acid, thio-, S-(2-fluoroethyl) ester?
The molecular formula of Acetic acid, thio-, S-(2-fluoroethyl) ester is C4H7FOS.
What is the molecular weight of Acetic acid, thio-, S-(2-fluoroethyl) ester?
The molecular weight of Acetic acid, thio-, S-(2-fluoroethyl) ester is 122.020164 g/mol.
What are the applications of Acetic acid, thio-, S-(2-fluoroethyl) ester?
Acetic acid, thio-, S-(2-fluoroethyl) ester is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation...
Where can I buy Acetic acid, thio-, S-(2-fluoroethyl) ester?
You can request a quote for Acetic acid, thio-, S-(2-fluoroethyl) ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, thio-, S-(2-fluoroethyl) ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, thio-, S-(2-fluoroethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.