![Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate structure](/static/products/866/866153-74-4.png)
Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate
TL;DR: Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate (CAS 866153-74-4) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-butan-2-ylphenoxy)benzoate
Also Known As: ethyl 3-[4-(butan-2-yl)phenoxy]benzoate, ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate, ethyl 3-(4-butan-2-ylphenoxy)benzoate, ethyl 3-(4-sec-butylphenoxy)benzoate, ethyl3-[4-(butan-2-yl)phenoxy]benzoate
| Molecular Formula | C19H22O3 |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 5.1691 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.1569 |
| Heavy Atoms | 22 |
| Complexity | 616.83234 |
Chemical Identifiers
| CAS Number | 866153-74-4 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)OCC |
Product Overview
Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate (CAS 866153-74-4), with molecular formula C19H22O3 and molecular weight 298.16 g/mol. IUPAC: ethyl 3-(4-butan-2-ylphenoxy)benzoate.
Chemical Property Profile of Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate
Property Insights of Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate
The XLogP value of 5.1691 indicates that Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate 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 Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate?
The CAS number of Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate is 866153-74-4.
What is the molecular formula of Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate?
The molecular formula of Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate is C19H22O3.
What is the molecular weight of Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate?
The molecular weight of Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate is 298.16 g/mol.
Where can I buy Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate?
You can request a quote for Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[4-(sec-butyl)phenoxy]benzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.