![2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate structure](/static/products/830/83046-66-6.png)
2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate
TL;DR: 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate (CAS 83046-66-6) is a chemical compound with molecular formula C22H26O3 and molecular weight 338.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(4-phenylphenyl)ethyl] octanoate
Also Known As: 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate, [2-oxo-2-(4-phenylphenyl)ethyl] octanoate, 1-biphenyl-4-yl-2-octanoyloxy-ethanone, 2-([1,1'-Biphenyl]-4-yl)-2-oxoethyl octanoate, 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate #
| Molecular Formula | C22H26O3 |
|---|---|
| Molecular Weight | 338.19 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 338.1882 |
| Heavy Atoms | 25 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 83046-66-6 |
|---|---|
| SMILES | CCCCCCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
| InChIKey | VEJHBNSTZDNKOS-UHFFFAOYSA-N |
Product Overview
2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate (CAS 83046-66-6), with molecular formula C22H26O3 and molecular weight 338.19 g/mol. IUPAC: [2-oxo-2-(4-phenylphenyl)ethyl] octanoate.
Chemical Property Profile of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate
Property Insights of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate
The XLogP value of 6.1 indicates that 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate 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 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate?
The CAS number of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate is 83046-66-6.
What is the molecular formula of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate?
The molecular formula of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate is C22H26O3.
What is the molecular weight of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate?
The molecular weight of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate is 338.19 g/mol.
Where can I buy 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate?
You can request a quote for 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.