![Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester structure](/static/products/1004/100486-95-1.webp)
Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester
TL;DR: Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester (CAS 100486-95-1) is a chemical compound with molecular formula C24H50N2O3 and molecular weight 414.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypropyl 3-[3-(2-ethylhexylamino)propylamino]-5,5-dimethyloctanoate
Also Known As: Neodecanoic acid, 3-((3-((2-ethylhexyl)amino)propyl)amino)-2-hydroxypropyl ester, 2-hydroxypropyl 3-[3-(2-ethylhexylamino)propylamino]-5,5-dimethyloctanoate, Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester, [3-[3-(2-ethylhexylamino)propylamino]-2-hydroxypropyl] 7,7-dimethyloctanoate, Neodecanoic acid,3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester
| Molecular Formula | C24H50N2O3 |
|---|---|
| Molecular Weight | 414.38 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 20 |
| Exact Mass | 414.38214 |
| Heavy Atoms | 29 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 100486-95-1 |
|---|---|
| SMILES | CCCCC(CC)CNCCCNC(CC(=O)OCC(C)O)CC(C)(C)CCC |
| InChIKey | MVIDYNMRRFMPKE-UHFFFAOYSA-N |
Product Overview
Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester (CAS 100486-95-1), with molecular formula C24H50N2O3 and molecular weight 414.38 g/mol. IUPAC: 2-hydroxypropyl 3-[3-(2-ethylhexylamino)propylamino]-5,5-dimethyloctanoate.
Chemical Property Profile of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester
Property Insights of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester
The XLogP value of 5.7 indicates that Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester. Following Lipinski's Rule of Five, Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester?
The CAS number of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester is 100486-95-1.
What is the molecular formula of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester?
The molecular formula of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester is C24H50N2O3.
What is the molecular weight of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester?
The molecular weight of Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester is 414.38 g/mol.
Where can I buy Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester?
You can request a quote for Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester?
Yes, KEHONG BIO provides custom synthesis services for Neodecanoic acid, 3-[[3-[(2-ethylhexyl)amino]propyl]amino]-2-hydroxypropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.