Decanoic acid, 2-acetyl-3-oxo-, ethyl ester
TL;DR: Decanoic acid, 2-acetyl-3-oxo-, ethyl ester (CAS 67342-98-7) is a chemical compound with molecular formula C14H24O4 and molecular weight 256.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetyl-3-oxodecanoate
Also Known As: Ethyl 2-acetyl-3-oxodecanoate, Ethyl alpha-acetyl-3-oxodecanoate, ethyl 2-acetyl-3-oxo-decanoate, Decanoic acid, 2-acetyl-3-oxo-, ethyl ester, 2-Acetyl-3-oxodecanoic acid ethyl ester
| Molecular Formula | C14H24O4 |
|---|---|
| Molecular Weight | 256.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 256.16745 |
| Heavy Atoms | 18 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 67342-98-7 |
|---|---|
| SMILES | CCCCCCCC(=O)C(C(=O)C)C(=O)OCC |
| InChIKey | HWJMRLHWXKAVSJ-UHFFFAOYSA-N |
Product Overview
Decanoic acid, 2-acetyl-3-oxo-, ethyl ester (CAS 67342-98-7), with molecular formula C14H24O4 and molecular weight 256.17 g/mol. IUPAC: ethyl 2-acetyl-3-oxodecanoate.
Chemical Property Profile of Decanoic acid, 2-acetyl-3-oxo-, ethyl ester
Property Insights of Decanoic acid, 2-acetyl-3-oxo-, ethyl ester
The XLogP value of 3.3 indicates that Decanoic acid, 2-acetyl-3-oxo-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Decanoic acid, 2-acetyl-3-oxo-, ethyl ester. Following Lipinski's Rule of Five, Decanoic acid, 2-acetyl-3-oxo-, ethyl ester 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 Decanoic acid, 2-acetyl-3-oxo-, ethyl ester?
The CAS number of Decanoic acid, 2-acetyl-3-oxo-, ethyl ester is 67342-98-7.
What is the molecular formula of Decanoic acid, 2-acetyl-3-oxo-, ethyl ester?
The molecular formula of Decanoic acid, 2-acetyl-3-oxo-, ethyl ester is C14H24O4.
What is the molecular weight of Decanoic acid, 2-acetyl-3-oxo-, ethyl ester?
The molecular weight of Decanoic acid, 2-acetyl-3-oxo-, ethyl ester is 256.17 g/mol.
Where can I buy Decanoic acid, 2-acetyl-3-oxo-, ethyl ester?
You can request a quote for Decanoic acid, 2-acetyl-3-oxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decanoic acid, 2-acetyl-3-oxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Decanoic acid, 2-acetyl-3-oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.