Einecs 261-230-7
TL;DR: Einecs 261-230-7 (CAS 71799-54-7) is a chemical compound with molecular formula C26H59N5O2 and molecular weight 473.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;octadecanoic acid
Also Known As: EC 272-225-4, Isostearic acid, tetraethylenepentamine condensate, Tetraethylenepentamine, stearic acid condensate, Reaction products of isostearic acid with tetraethylenepentamine, Isooctadecanoic acid, reaction products with tetraethylenepentamine
| Molecular Formula | C26H59N5O2 |
|---|---|
| Molecular Weight | 473.47 g/mol |
| LogP | 4.0051 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 26 |
| Exact Mass | 473.4669 |
| Heavy Atoms | 33 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 71799-54-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)O.C(CNCCNCCNCCN)N |
| InChIKey | CDCSRZWJRXOXLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Einecs 261-230-7 (CAS 71799-54-7), with molecular formula C26H59N5O2 and molecular weight 473.47 g/mol. IUPAC: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;octadecanoic acid.
Chemical Property Profile of Einecs 261-230-7
Property Insights of Einecs 261-230-7
The XLogP value of 4.0051 indicates that Einecs 261-230-7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 261-230-7. Following Lipinski's Rule of Five, Einecs 261-230-7 has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Einecs 261-230-7?
The CAS number of Einecs 261-230-7 is 71799-54-7.
What is the molecular formula of Einecs 261-230-7?
The molecular formula of Einecs 261-230-7 is C26H59N5O2.
What is the molecular weight of Einecs 261-230-7?
The molecular weight of Einecs 261-230-7 is 473.47 g/mol.
Where can I buy Einecs 261-230-7?
You can request a quote for Einecs 261-230-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 261-230-7?
Yes, KEHONG BIO provides custom synthesis services for Einecs 261-230-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.