2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate
TL;DR: 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate (CAS 5327-30-0) is a chemical compound with molecular formula C28H41NO4 and molecular weight 455.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)ethyl octadec-9-enoate
Also Known As: 2-(1,3-dioxoisoindol-2-yl)ethyl octadec-9-enoate, 2-Cyan-3-(N'-methyl-ureido)-acrylsaeure-aethylester, 2-(1,3-dioxoisoindol-2-yl)ethyl (E)-octadec-9-enoate, 2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)ethyl octadec-9-enoate
| Molecular Formula | C28H41NO4 |
|---|---|
| Molecular Weight | 455.30 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 19 |
| Exact Mass | 455.30356 |
| Heavy Atoms | 33 |
| Complexity | 591.0 |
Chemical Identifiers
| CAS Number | 5327-30-0 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCCN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | NBROGIBKWCOXJE-UHFFFAOYSA-N |
Product Overview
2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate (CAS 5327-30-0), with molecular formula C28H41NO4 and molecular weight 455.30 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)ethyl octadec-9-enoate.
Chemical Property Profile of 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate
Property Insights of 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate
The XLogP value of 8.3 indicates that 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate. Following Lipinski's Rule of Five, 2-(1,3-Dioxoisoindol-2-yl)ethyl 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-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate?
The CAS number of 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate is 5327-30-0.
What is the molecular formula of 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate?
The molecular formula of 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate is C28H41NO4.
What is the molecular weight of 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate?
The molecular weight of 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate is 455.30 g/mol.
Where can I buy 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate?
You can request a quote for 2-(1,3-Dioxoisoindol-2-yl)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-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Dioxoisoindol-2-yl)ethyl octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.