2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate
TL;DR: 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate (CAS 72230-96-7) is a chemical compound with molecular formula C22H42O3S and molecular weight 386.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxyethylsulfanyl)ethyl octadec-9-enoate
Also Known As: Thiodiglycol oleate, 2-(2-hydroxyethylsulfanyl)ethyl (E)-octadec-9-enoate, 9-Octadecenoic acid (9Z)-, 2-[(2-hydroxyethyl)thio]ethyl ester, 9-Octadecenoic acid (9Z)-, 2-((2-hydroxyethyl)thio)ethyl ester, 9-Octadecenoic acid (Z)-, 2-[(2-hydroxyethyl)thio]ethyl ester
| Molecular Formula | C22H42O3S |
|---|---|
| Molecular Weight | 386.29 g/mol |
| LogP | 6.2926 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 386.28546 |
| Heavy Atoms | 26 |
| Complexity | 318.50922 |
Chemical Identifiers
| CAS Number | 72230-96-7 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCCSCCO |
Product Overview
2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate (CAS 72230-96-7), with molecular formula C22H42O3S and molecular weight 386.29 g/mol. IUPAC: 2-(2-hydroxyethylsulfanyl)ethyl octadec-9-enoate.
Chemical Property Profile of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate
Property Insights of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate
The XLogP value of 6.2926 indicates that 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate?
The CAS number of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate is 72230-96-7.
What is the molecular formula of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate?
The molecular formula of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate is C22H42O3S.
What is the molecular weight of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate?
The molecular weight of 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate is 386.29 g/mol.
Where can I buy 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate?
You can request a quote for 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Hydroxyethylsulfanyl)ethyl octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.