Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester
TL;DR: Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester (CAS 55822-92-9) is a chemical compound with molecular formula C13H26O3 and molecular weight 230.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-ethyl-3-hydroxynonanoate
Also Known As: Ethyl 2-ethyl-3-hydroxynonanoate, Ethyl 2-ethyl-3-hydroxynonanoate #, 2-Ethyl-3-hydroxynonanoic acid ethyl ester, Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester
| Molecular Formula | C13H26O3 |
|---|---|
| Molecular Weight | 230.19 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 230.1882 |
| Heavy Atoms | 16 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 55822-92-9 |
|---|---|
| SMILES | CCCCCCC(C(CC)C(=O)OCC)O |
| InChIKey | BJNWUSPEGNZNFQ-UHFFFAOYSA-N |
Product Overview
Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester (CAS 55822-92-9), with molecular formula C13H26O3 and molecular weight 230.19 g/mol. IUPAC: ethyl 2-ethyl-3-hydroxynonanoate.
Chemical Property Profile of Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester
Property Insights of Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester
The XLogP value of 3.6 indicates that Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester has 1 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 Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester?
The CAS number of Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester is 55822-92-9.
What is the molecular formula of Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester?
The molecular formula of Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester is C13H26O3.
What is the molecular weight of Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester?
The molecular weight of Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester is 230.19 g/mol.
Where can I buy Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester?
You can request a quote for Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Nonanoic acid, 2-ethyl-3-hydroxy-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.