![Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate structure](/static/products/6312/6312-27-2.webp)
Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate
TL;DR: Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate (CAS 6312-27-2) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-methyl-2-(2-pyridin-2-ylethyl)butanoate
Also Known As: ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate, ethyl 3-methyl-2-(2-pyridin-2-ylethyl)butanoate, 1-phenyl-3-pyridin-4-yl-propane-1,3-dione
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 6312-27-2 |
|---|---|
| SMILES | CCOC(=O)C(CCC1=CC=CC=N1)C(C)C |
| InChIKey | BNQJERDDDIMRMH-UHFFFAOYSA-N |
Product Overview
Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate (CAS 6312-27-2), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: ethyl 3-methyl-2-(2-pyridin-2-ylethyl)butanoate.
Chemical Property Profile of Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate
Property Insights of Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate
The XLogP value of 3.1 indicates that Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate has 0 hydrogen bond donor(s) and 3 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 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate?
The CAS number of Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate is 6312-27-2.
What is the molecular formula of Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate?
The molecular formula of Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate is C14H21NO2.
What is the molecular weight of Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate?
The molecular weight of Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate is 235.16 g/mol.
Where can I buy Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate?
You can request a quote for Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-methyl-2-[2-(pyridin-2-yl)ethyl]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.