3-Hydroxybutyl(dioctadecyl)azanium chloride
TL;DR: 3-Hydroxybutyl(dioctadecyl)azanium chloride (CAS 94278-98-5) is a chemical compound with molecular formula C40H84ClNO and molecular weight 629.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxybutyl(dioctadecyl)azanium chloride
Also Known As: 3-hydroxybutyl(dioctadecyl)azanium chloride, 3-hydroxybutyl-dioctadecyl-azanium chloride, (2-Hydroxypropyl)methyldioctadecylammonium chloride
| Molecular Formula | C40H84ClNO |
|---|---|
| Molecular Weight | 629.62 g/mol |
| LogP | 9.1692 |
| Topological Polar Surface Area | 24.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 37 |
| Exact Mass | 629.62415 |
| Heavy Atoms | 43 |
| Complexity | 435.40692 |
Chemical Identifiers
| CAS Number | 94278-98-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC[NH+](CCCCCCCCCCCCCCCCCC)CCC(C)O.[Cl-] |
Product Overview
3-Hydroxybutyl(dioctadecyl)azanium chloride (CAS 94278-98-5), with molecular formula C40H84ClNO and molecular weight 629.62 g/mol. IUPAC: 3-hydroxybutyl(dioctadecyl)azanium chloride.
Chemical Property Profile of 3-Hydroxybutyl(dioctadecyl)azanium chloride
Property Insights of 3-Hydroxybutyl(dioctadecyl)azanium chloride
The XLogP value of 9.1692 indicates that 3-Hydroxybutyl(dioctadecyl)azanium chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.67 Ų, 3-Hydroxybutyl(dioctadecyl)azanium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxybutyl(dioctadecyl)azanium chloride has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Hydroxybutyl(dioctadecyl)azanium chloride?
The CAS number of 3-Hydroxybutyl(dioctadecyl)azanium chloride is 94278-98-5.
What is the molecular formula of 3-Hydroxybutyl(dioctadecyl)azanium chloride?
The molecular formula of 3-Hydroxybutyl(dioctadecyl)azanium chloride is C40H84ClNO.
What is the molecular weight of 3-Hydroxybutyl(dioctadecyl)azanium chloride?
The molecular weight of 3-Hydroxybutyl(dioctadecyl)azanium chloride is 629.62 g/mol.
Where can I buy 3-Hydroxybutyl(dioctadecyl)azanium chloride?
You can request a quote for 3-Hydroxybutyl(dioctadecyl)azanium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxybutyl(dioctadecyl)azanium chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxybutyl(dioctadecyl)azanium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.