Ethyl 2-acetyl-5,5-diethoxypentanoate
TL;DR: Ethyl 2-acetyl-5,5-diethoxypentanoate (CAS 17159-83-0) is a chemical compound with molecular formula C13H24O5 and molecular weight 260.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetyl-5,5-diethoxypentanoate
Also Known As: ethyl 2-acetyl-5,5-diethoxypentanoate, Pentanoicacid, 2-acetyl-5,5-diethoxy-, ethyl ester
| Molecular Formula | C13H24O5 |
|---|---|
| Molecular Weight | 260.16 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 260.16238 |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 17159-83-0 |
|---|---|
| SMILES | CCOC(CCC(C(=O)C)C(=O)OCC)OCC |
| InChIKey | WHWDESABZHYAQR-UHFFFAOYSA-N |
Product Overview
Ethyl 2-acetyl-5,5-diethoxypentanoate (CAS 17159-83-0), with molecular formula C13H24O5 and molecular weight 260.16 g/mol. IUPAC: ethyl 2-acetyl-5,5-diethoxypentanoate.
Chemical Property Profile of Ethyl 2-acetyl-5,5-diethoxypentanoate
Property Insights of Ethyl 2-acetyl-5,5-diethoxypentanoate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-acetyl-5,5-diethoxypentanoate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-acetyl-5,5-diethoxypentanoate. Following Lipinski's Rule of Five, Ethyl 2-acetyl-5,5-diethoxypentanoate has 0 hydrogen bond donor(s) and 5 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 Ethyl 2-acetyl-5,5-diethoxypentanoate?
The CAS number of Ethyl 2-acetyl-5,5-diethoxypentanoate is 17159-83-0.
What is the molecular formula of Ethyl 2-acetyl-5,5-diethoxypentanoate?
The molecular formula of Ethyl 2-acetyl-5,5-diethoxypentanoate is C13H24O5.
What is the molecular weight of Ethyl 2-acetyl-5,5-diethoxypentanoate?
The molecular weight of Ethyl 2-acetyl-5,5-diethoxypentanoate is 260.16 g/mol.
Where can I buy Ethyl 2-acetyl-5,5-diethoxypentanoate?
You can request a quote for Ethyl 2-acetyl-5,5-diethoxypentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-acetyl-5,5-diethoxypentanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-acetyl-5,5-diethoxypentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.