![5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole structure](/static/products/906/90632-71-6.png)
5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole
TL;DR: 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole (CAS 90632-71-6) is a chemical compound with molecular formula C16H15FO3 and molecular weight 274.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[1-(4-fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole
Also Known As: 5-[1-(4-fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole, 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-2H-1,3-benzodioxole
| Molecular Formula | C16H15FO3 |
|---|---|
| Molecular Weight | 274.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.10052 |
| Heavy Atoms | 20 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 90632-71-6 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)F)C2=CC3=C(C=C2OC)OCO3 |
| InChIKey | DUXHDPMGAMLDGV-UHFFFAOYSA-N |
Product Overview
5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole (CAS 90632-71-6), with molecular formula C16H15FO3 and molecular weight 274.10 g/mol. IUPAC: 5-[1-(4-fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole.
Chemical Property Profile of 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole
Property Insights of 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole
The XLogP value of 4.1 indicates that 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole 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 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole?
The CAS number of 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole is 90632-71-6.
What is the molecular formula of 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole?
The molecular formula of 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole is C16H15FO3.
What is the molecular weight of 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole?
The molecular weight of 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole is 274.10 g/mol.
Where can I buy 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole?
You can request a quote for 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole?
Yes, KEHONG BIO provides custom synthesis services for 5-[1-(4-Fluorophenyl)ethyl]-6-methoxy-1,3-benzodioxole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.