RefChem:79833
TL;DR: RefChem:79833 (CAS 68609-69-8) is a chemical compound with molecular formula C24H48N2O2 and molecular weight 396.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]ethanolate
Also Known As: 1H-Imidazolium, 2-heptadecyl-4,5-dihydro-1,1(or 1,3)-bis(2-hydroxyethyl)-, inner salt, Stearic acid, aminoethylethanolamine reaction product, ethylenechlorohydrin alkylated, 2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydro-1h-imidazol-1-ium-1-yl]ethanolate, Stearic acid, aminoethylethanolamine, amide-imidazoline, ethylenechlorohydrin, alkylated, 2-Heptadecyl-4,5-dihydro-1,1(or 1,3)-bis(2-hydroxyethyl)-1-H-imidazolium hydroxide
| Molecular Formula | C24H48N2O2 |
|---|---|
| Molecular Weight | 396.37 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 55.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 20 |
| Exact Mass | 396.37158 |
| Heavy Atoms | 28 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 68609-69-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC[O-] |
| InChIKey | NMUJFTZVTCZJBE-UHFFFAOYSA-N |
Product Overview
RefChem:79833 (CAS 68609-69-8), with molecular formula C24H48N2O2 and molecular weight 396.37 g/mol. IUPAC: 2-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]ethanolate.
Chemical Property Profile of RefChem:79833
Property Insights of RefChem:79833
The XLogP value of 7.9 indicates that RefChem:79833 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.7 Ų, RefChem:79833 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:79833 has 1 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 RefChem:79833?
The CAS number of RefChem:79833 is 68609-69-8.
What is the molecular formula of RefChem:79833?
The molecular formula of RefChem:79833 is C24H48N2O2.
What is the molecular weight of RefChem:79833?
The molecular weight of RefChem:79833 is 396.37 g/mol.
Where can I buy RefChem:79833?
You can request a quote for RefChem:79833 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:79833?
Yes, KEHONG BIO provides custom synthesis services for RefChem:79833 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.