2-Ethylhexyl epoxystearate
TL;DR: 2-Ethylhexyl epoxystearate (CAS 141-38-8) is a chemical compound with molecular formula C26H50O3 and molecular weight 410.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexyl 8-(3-octyloxiran-2-yl)octanoate
Also Known As: 2-ETHYLHEXYL EPOXYSTEARATE, 2-Ethylhexyl 9,10-epoxystearate, 2-Ethylhexyl 9,10-epoxyoctadecanoate, 2-ethylhexyl 8-(3-octyloxiran-2-yl)octanoate, 9,10-Epoxyoctadecanoic acid, 2-ethylhexyl ester
| Molecular Formula | C26H50O3 |
|---|---|
| Molecular Weight | 410.38 g/mol |
| LogP | 9.6 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 22 |
| Exact Mass | 410.376 |
| Heavy Atoms | 29 |
| Complexity | 382.0 |
| Density | 0.0894 at 25.0 °C - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| Flash Point | greater than 93.3 °C |
| Vapor Pressure | 5.2 mmHg at 25.0 °C ; 6.6 mmHg at 34.5 °C |
Chemical Identifiers
| CAS Number | 141-38-8 |
|---|---|
| SMILES | CCCCCCCCC1C(O1)CCCCCCCC(=O)OCC(CC)CCCC |
| InChIKey | PUYRISKXBBQECH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethylhexyl epoxystearate (CAS 141-38-8), with molecular formula C26H50O3 and molecular weight 410.38 g/mol. IUPAC: 2-ethylhexyl 8-(3-octyloxiran-2-yl)octanoate.
Chemical Property Profile of 2-Ethylhexyl epoxystearate
Property Insights of 2-Ethylhexyl epoxystearate
The XLogP value of 9.6 indicates that 2-Ethylhexyl epoxystearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 2-Ethylhexyl epoxystearate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylhexyl epoxystearate 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-Ethylhexyl epoxystearate?
The CAS number of 2-Ethylhexyl epoxystearate is 141-38-8.
What is the molecular formula of 2-Ethylhexyl epoxystearate?
The molecular formula of 2-Ethylhexyl epoxystearate is C26H50O3.
What is the molecular weight of 2-Ethylhexyl epoxystearate?
The molecular weight of 2-Ethylhexyl epoxystearate is 410.38 g/mol.
Where can I buy 2-Ethylhexyl epoxystearate?
You can request a quote for 2-Ethylhexyl epoxystearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexyl epoxystearate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexyl epoxystearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.