Butyl 2-(4-fluorophenoxy)acetate
TL;DR: Butyl 2-(4-fluorophenoxy)acetate (CAS 1426-73-9) is a chemical compound with molecular formula C12H15FO3 and molecular weight 226.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-(4-fluorophenoxy)acetate
Also Known As: butyl 2-(4-fluorophenoxy)acetate, Butyl (4-fluorophenoxy)acetate, 2-iodo-2-phenyl-N-tosylethanamine, Acetic acid,2-(4-fluorophenoxy)-, butyl ester
| Molecular Formula | C12H15FO3 |
|---|---|
| Molecular Weight | 226.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 226.10052 |
| Heavy Atoms | 16 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 1426-73-9 |
|---|---|
| SMILES | CCCCOC(=O)COC1=CC=C(C=C1)F |
| InChIKey | HORFJSRJZCRANO-UHFFFAOYSA-N |
Product Overview
Butyl 2-(4-fluorophenoxy)acetate (CAS 1426-73-9), with molecular formula C12H15FO3 and molecular weight 226.10 g/mol. IUPAC: butyl 2-(4-fluorophenoxy)acetate.
Chemical Property Profile of Butyl 2-(4-fluorophenoxy)acetate
Property Insights of Butyl 2-(4-fluorophenoxy)acetate
The XLogP value of 3.2 indicates that Butyl 2-(4-fluorophenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Butyl 2-(4-fluorophenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 2-(4-fluorophenoxy)acetate has 0 hydrogen bond donor(s) and 4 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 Butyl 2-(4-fluorophenoxy)acetate?
The CAS number of Butyl 2-(4-fluorophenoxy)acetate is 1426-73-9.
What is the molecular formula of Butyl 2-(4-fluorophenoxy)acetate?
The molecular formula of Butyl 2-(4-fluorophenoxy)acetate is C12H15FO3.
What is the molecular weight of Butyl 2-(4-fluorophenoxy)acetate?
The molecular weight of Butyl 2-(4-fluorophenoxy)acetate is 226.10 g/mol.
Where can I buy Butyl 2-(4-fluorophenoxy)acetate?
You can request a quote for Butyl 2-(4-fluorophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2-(4-fluorophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-(4-fluorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.