Undecyl octanoate
TL;DR: Undecyl octanoate (CAS 42231-40-3) is a chemical compound with molecular formula C19H38O2 and molecular weight 298.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
undecyl octanoate
Also Known As: Undecyl octanoate, EINECS 255-717-3, Octanoic acid undecyl ester, 255-717-3, RefChem:193114
| Molecular Formula | C19H38O2 |
|---|---|
| Molecular Weight | 298.29 g/mol |
| LogP | 6.4209 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 298.28717 |
| Heavy Atoms | 21 |
| Complexity | 213.6119 |
Chemical Identifiers
| CAS Number | 42231-40-3 |
|---|---|
| SMILES | CCCCCCCCCCCOC(=O)CCCCCCC |
Product Overview
Undecyl octanoate (CAS 42231-40-3), with molecular formula C19H38O2 and molecular weight 298.29 g/mol. IUPAC: undecyl octanoate.
Chemical Property Profile of Undecyl octanoate
Property Insights of Undecyl octanoate
The XLogP value of 6.4209 indicates that Undecyl octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Undecyl octanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Undecyl octanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Undecyl octanoate?
The CAS number of Undecyl octanoate is 42231-40-3.
What is the molecular formula of Undecyl octanoate?
The molecular formula of Undecyl octanoate is C19H38O2.
What is the molecular weight of Undecyl octanoate?
The molecular weight of Undecyl octanoate is 298.29 g/mol.
Where can I buy Undecyl octanoate?
You can request a quote for Undecyl octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Undecyl octanoate?
Yes, KEHONG BIO provides custom synthesis services for Undecyl octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.