Acetic acid, fluoro-, isopropyl ester
TL;DR: Acetic acid, fluoro-, isopropyl ester (CAS 406-06-4) is a chemical compound with molecular formula C5H9FO2 and molecular weight 120.058655 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl 2-fluoroacetate
Also Known As: Isopropyl fluoroacetate, propan-2-yl 2-fluoroacetate, Fluoroaceticacidisopropylester, propan-2-yl fluoroacetate, TL 630
Technical Specifications
| Molecular Formula | C5H9FO2 |
| Molecular Weight | 120.058655 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 120.058655 Da |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
| SMILES | CC(C)OC(=O)CF |
| InChIKey | HERCSPPGAAQXBN-UHFFFAOYSA-N |
Product Description
Applications: Acetic acid, fluoro-, isopropyl 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, fluoro-, isopropyl ester (CAS 406-06-4) is a fine chemical with the molecular formula C5H9FO2 and a molecular weight of 120.06 g/mol. Synonyms include Isopropyl fluoroacetate and propan-2-yl 2-fluoroacetate.
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, fluoro-, isopropyl ester
Property Insights of Acetic acid, fluoro-, isopropyl ester
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, fluoro-, isopropyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Acetic acid, fluoro-, isopropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, fluoro-, isopropyl 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, fluoro-, isopropyl ester?
The CAS number of Acetic acid, fluoro-, isopropyl ester is 406-06-4.
What is the molecular formula of Acetic acid, fluoro-, isopropyl ester?
The molecular formula of Acetic acid, fluoro-, isopropyl ester is C5H9FO2.
What is the molecular weight of Acetic acid, fluoro-, isopropyl ester?
The molecular weight of Acetic acid, fluoro-, isopropyl ester is 120.058655 g/mol.
What are the applications of Acetic acid, fluoro-, isopropyl ester?
Acetic acid, fluoro-, isopropyl 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,...
Where can I buy Acetic acid, fluoro-, isopropyl ester?
You can request a quote for Acetic acid, fluoro-, isopropyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, fluoro-, isopropyl ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, fluoro-, isopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.