Butyric acid, 4-fluoro-, methyl ester
TL;DR: Butyric acid, 4-fluoro-, methyl ester (CAS 406-20-2) 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.
methyl 4-fluorobutanoate
Also Known As: methyl 4-fluorobutanoate, 4-Fluorobutyric acid methyl ester, Methyl 4-fluorobutyrate, Methyl gamma-fluorobutyrate, Methylester kyseliny 4-fluormaselne
Technical Specifications
| Molecular Formula | C5H9FO2 |
| Molecular Weight | 120.058655 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 120.058655 Da |
| Heavy Atoms | 8 |
| Complexity | 72.0 |
| SMILES | COC(=O)CCCF |
| InChIKey | ZVGDFKFLRMGSFF-UHFFFAOYSA-N |
Product Description
Applications: Butyric acid, 4-fluoro-, methyl 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).
Butyric acid, 4-fluoro-, methyl ester (CAS 406-20-2) is a fine chemical with the molecular formula C5H9FO2 and a molecular weight of 120.06 g/mol. Synonyms include methyl 4-fluorobutanoate and 4-Fluorobutyric acid methyl ester.
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 Butyric acid, 4-fluoro-, methyl ester
Property Insights of Butyric acid, 4-fluoro-, methyl ester
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyric acid, 4-fluoro-, methyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Butyric acid, 4-fluoro-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 4-fluoro-, methyl 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 Butyric acid, 4-fluoro-, methyl ester?
The CAS number of Butyric acid, 4-fluoro-, methyl ester is 406-20-2.
What is the molecular formula of Butyric acid, 4-fluoro-, methyl ester?
The molecular formula of Butyric acid, 4-fluoro-, methyl ester is C5H9FO2.
What is the molecular weight of Butyric acid, 4-fluoro-, methyl ester?
The molecular weight of Butyric acid, 4-fluoro-, methyl ester is 120.058655 g/mol.
What are the applications of Butyric acid, 4-fluoro-, methyl ester?
Butyric acid, 4-fluoro-, methyl 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 Butyric acid, 4-fluoro-, methyl ester?
You can request a quote for Butyric acid, 4-fluoro-, methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyric acid, 4-fluoro-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Butyric acid, 4-fluoro-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.