(Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid
TL;DR: (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid (CAS 68187-07-5) is a chemical compound with molecular formula C24H41NO5 and molecular weight 423.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid
Also Known As: EINECS 269-068-9, 2-Butenedioicacid -, -2-[ amino]ethylester, 2-Butenedioic acid (2Z)-, 2-(((9Z)-1-oxo-9-octadecen-1-yl)amino)ethyl ester, sulfonated, sodium salt, 2-Butenedioic acid (2Z)-, 2-(((9Z)-1-oxo-9-octadecenyl)amino)ethyl ester, sulfonated, sodium salt, 2-Butenedioic acid (Z)-, (Z)-2-((1-oxo-9-octadecenyl)amino)ethyl ester, sulfonated, sodium salt
| Molecular Formula | C24H41NO5 |
|---|---|
| Molecular Weight | 423.30 g/mol |
| LogP | 5.6717 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 19 |
| Exact Mass | 423.29846 |
| Heavy Atoms | 30 |
| Complexity | 539.71436 |
Chemical Identifiers
| CAS Number | 68187-07-5 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)N/C(=C\C(=O)O)/C(=O)OCC |
Product Overview
(Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid (CAS 68187-07-5), with molecular formula C24H41NO5 and molecular weight 423.30 g/mol. IUPAC: (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid.
Chemical Property Profile of (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid
Property Insights of (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid
The XLogP value of 5.6717 indicates that (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid has 2 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 (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid?
The CAS number of (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid is 68187-07-5.
What is the molecular formula of (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid?
The molecular formula of (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid is C24H41NO5.
What is the molecular weight of (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid?
The molecular weight of (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid is 423.30 g/mol.
Where can I buy (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid?
You can request a quote for (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-ethoxy-3-[[(Z)-octadec-9-enoyl]amino]-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.