![[2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate structure](/static/products/7598/7598-47-2.webp)
[2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate
TL;DR: [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate (CAS 7598-47-2) is a chemical compound with molecular formula C21H24O3 and molecular weight 324.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate
Also Known As: [2-oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate|2-([1,1'-Biphenyl]-4-yl)-2-oxoethyl 5-methylhexanoate
| Molecular Formula | C21H24O3 |
|---|---|
| Molecular Weight | 324.17 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 324.17255 |
| Heavy Atoms | 24 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 7598-47-2 |
|---|---|
| SMILES | CC(C)CCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
| InChIKey | KJLHQTOFHBVTLQ-UHFFFAOYSA-N |
Product Overview
[2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate (CAS 7598-47-2), with molecular formula C21H24O3 and molecular weight 324.17 g/mol. IUPAC: [2-oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate.
Chemical Property Profile of [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate
Property Insights of [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate
The XLogP value of 5.3 indicates that [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate 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-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate 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-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate?
The CAS number of [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate is 7598-47-2.
What is the molecular formula of [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate?
The molecular formula of [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate is C21H24O3.
What is the molecular weight of [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate?
The molecular weight of [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate is 324.17 g/mol.
Where can I buy [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate?
You can request a quote for [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate?
Yes, KEHONG BIO provides custom synthesis services for [2-Oxo-2-(4-phenylphenyl)ethyl] 5-methylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.