![4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate structure](/static/products/863/86349-52-2.png)
4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate
TL;DR: 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate (CAS 86349-52-2) is a chemical compound with molecular formula C20H21FO2 and molecular weight 312.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-ethyl-1-(4-fluorophenyl)but-1-enyl]phenyl] acetate
Also Known As: NCIOpen2_009691, para-methoxy-2-ethylbutyrophenone, 4-[2-ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate, [4-[2-ethyl-1-(4-fluorophenyl)but-1-enyl]phenyl] acetate
| Molecular Formula | C20H21FO2 |
|---|---|
| Molecular Weight | 312.15 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.15256 |
| Heavy Atoms | 23 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 86349-52-2 |
|---|---|
| SMILES | CCC(=C(C1=CC=C(C=C1)OC(=O)C)C2=CC=C(C=C2)F)CC |
| InChIKey | LFVPWWCXDKGUCR-UHFFFAOYSA-N |
Product Overview
4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate (CAS 86349-52-2), with molecular formula C20H21FO2 and molecular weight 312.15 g/mol. IUPAC: [4-[2-ethyl-1-(4-fluorophenyl)but-1-enyl]phenyl] acetate.
Chemical Property Profile of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate
Property Insights of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate
The XLogP value of 6.2 indicates that 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate?
The CAS number of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate is 86349-52-2.
What is the molecular formula of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate?
The molecular formula of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate is C20H21FO2.
What is the molecular weight of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate?
The molecular weight of 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate is 312.15 g/mol.
Where can I buy 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate?
You can request a quote for 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-Ethyl-1-(4-fluorophenyl)but-1-en-1-yl]phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.