RefChem:138075
TL;DR: RefChem:138075 (CAS 68134-09-8) is a chemical compound with molecular formula C25H54N2O6S and molecular weight 510.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl-dimethyl-[2-(octadecanoylamino)ethyl]azanium;methyl sulfate
Also Known As: Ethanaminium, 2-hydroxy-N,N-dimethyl-N-(2-((1-oxooctadecyl)amino)ethyl)-, methyl sulfate (salt), Ethanaminium, 2-hydroxy-N,N-dimethyl-N-[2-[(1-oxooctadecyl)amino]ethyl]-, methyl sulfate (salt), Ethanaminium, 2-hydroxy-N,N-dimethyl-N-(2-((1-oxooctadecyl)amino)ethyl)-, methyl sulfate (1:1), 2-hydroxy-n,n-dimethyl-n-[2-(stearoylamino)ethyl]ethanaminium methyl sulfate, 2-hydroxyethyl-dimethyl-[2-(octadecanoylamino)ethyl]azanium; methyl sulfate
| Molecular Formula | C25H54N2O6S |
|---|---|
| Molecular Weight | 510.37 g/mol |
| LogP | 4.53 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 21 |
| Exact Mass | 510.37027 |
| Heavy Atoms | 34 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 68134-09-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)NCC[N+](C)(C)CCO.COS(=O)(=O)[O-] |
| InChIKey | DNPFWOWNWPZQJB-UHFFFAOYSA-N |
Product Overview
RefChem:138075 (CAS 68134-09-8), with molecular formula C25H54N2O6S and molecular weight 510.37 g/mol. IUPAC: 2-hydroxyethyl-dimethyl-[2-(octadecanoylamino)ethyl]azanium;methyl sulfate.
Chemical Property Profile of RefChem:138075
Property Insights of RefChem:138075
The XLogP value of 4.53 indicates that RefChem:138075 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:138075. Following Lipinski's Rule of Five, RefChem:138075 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:138075?
The CAS number of RefChem:138075 is 68134-09-8.
What is the molecular formula of RefChem:138075?
The molecular formula of RefChem:138075 is C25H54N2O6S.
What is the molecular weight of RefChem:138075?
The molecular weight of RefChem:138075 is 510.37 g/mol.
Where can I buy RefChem:138075?
You can request a quote for RefChem:138075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:138075?
Yes, KEHONG BIO provides custom synthesis services for RefChem:138075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.