2-Hexadecoxyethyl octadecanoate
TL;DR: 2-Hexadecoxyethyl octadecanoate (CAS 34639-56-0) is a chemical compound with molecular formula C36H72O3 and molecular weight 552.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexadecoxyethyl octadecanoate
Also Known As: 2-hexadecoxyethyl octadecanoate, 2-(hexadecyloxy)ethyl octadecanoate, 2-(Hexadecyloxy)ethyl stearate #, 1-Hexadecyl-2-stearoyl ethanediol, Octadecanoic acid, 2-(hexadecyloxy)ethyl ester
| Molecular Formula | C36H72O3 |
|---|---|
| Molecular Weight | 552.55 g/mol |
| LogP | 16.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 35 |
| Exact Mass | 552.54816 |
| Heavy Atoms | 39 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 34639-56-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCCOCCCCCCCCCCCCCCCC |
| InChIKey | KWRXMYLSDRSIEB-UHFFFAOYSA-N |
Product Overview
2-Hexadecoxyethyl octadecanoate (CAS 34639-56-0), with molecular formula C36H72O3 and molecular weight 552.55 g/mol. IUPAC: 2-hexadecoxyethyl octadecanoate.
Chemical Property Profile of 2-Hexadecoxyethyl octadecanoate
Property Insights of 2-Hexadecoxyethyl octadecanoate
The XLogP value of 16.1 indicates that 2-Hexadecoxyethyl octadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Hexadecoxyethyl octadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexadecoxyethyl octadecanoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Hexadecoxyethyl octadecanoate?
The CAS number of 2-Hexadecoxyethyl octadecanoate is 34639-56-0.
What is the molecular formula of 2-Hexadecoxyethyl octadecanoate?
The molecular formula of 2-Hexadecoxyethyl octadecanoate is C36H72O3.
What is the molecular weight of 2-Hexadecoxyethyl octadecanoate?
The molecular weight of 2-Hexadecoxyethyl octadecanoate is 552.55 g/mol.
Where can I buy 2-Hexadecoxyethyl octadecanoate?
You can request a quote for 2-Hexadecoxyethyl octadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hexadecoxyethyl octadecanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hexadecoxyethyl octadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.