2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate
TL;DR: 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate (CAS 36557-00-3) is a chemical compound with molecular formula C22H40O4 and molecular weight 368.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-2-oxoethyl) (E)-octadec-9-enoate
Also Known As: (2-ethoxy-2-oxoethyl) (E)-octadec-9-enoate, 2-ETHOXY-2-OXOETHYL (9E)-OCTADEC-9-ENOATE, 9-Octadecenoic acid(9Z)-, 2-ethoxy-2-oxoethyl ester
| Molecular Formula | C22H40O4 |
|---|---|
| Molecular Weight | 368.29 g/mol |
| LogP | 6.1302 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 368.29266 |
| Heavy Atoms | 26 |
| Complexity | 363.15375 |
Chemical Identifiers
| CAS Number | 36557-00-3 |
|---|---|
| SMILES | CCCCCCCC/C=C/CCCCCCCC(=O)OCC(=O)OCC |
Product Overview
2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate (CAS 36557-00-3), with molecular formula C22H40O4 and molecular weight 368.29 g/mol. IUPAC: (2-ethoxy-2-oxoethyl) (E)-octadec-9-enoate.
Chemical Property Profile of 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate
Property Insights of 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate
The XLogP value of 6.1302 indicates that 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate has 0 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-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate?
The CAS number of 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate is 36557-00-3.
What is the molecular formula of 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate?
The molecular formula of 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate is C22H40O4.
What is the molecular weight of 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate?
The molecular weight of 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate is 368.29 g/mol.
Where can I buy 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate?
You can request a quote for 2-Ethoxy-2-oxoethyl (9E)-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-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethoxy-2-oxoethyl (9E)-octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.