9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester
TL;DR: 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester (CAS 45296-12-6) is a chemical compound with molecular formula C24H47NO2 and molecular weight 381.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl octadec-9-enoate
Also Known As: 2-(Diethylamino)ethyl oleate, 1-Octanaminium,N-ethyl-N,N-dioctyl, 2-(diethylamino)ethyl octadec-9-enoate, 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester, EINECS 256-223-0
| Molecular Formula | C24H47NO2 |
|---|---|
| Molecular Weight | 381.36 g/mol |
| LogP | 8.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 21 |
| Exact Mass | 381.3607 |
| Heavy Atoms | 27 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 45296-12-6 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCCN(CC)CC |
| InChIKey | VWTYZZXUXJVLIO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester (CAS 45296-12-6), with molecular formula C24H47NO2 and molecular weight 381.36 g/mol. IUPAC: 2-(diethylamino)ethyl octadec-9-enoate.
Chemical Property Profile of 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester
Property Insights of 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester
The XLogP value of 8.4 indicates that 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester 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 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester?
The CAS number of 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester is 45296-12-6.
What is the molecular formula of 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester?
The molecular formula of 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester is C24H47NO2.
What is the molecular weight of 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester?
The molecular weight of 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester is 381.36 g/mol.
Where can I buy 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester?
You can request a quote for 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 9-Octadecenoic acid (9Z)-, 2-(diethylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.