EINECS 262-863-1
TL;DR: EINECS 262-863-1 (CAS 61596-15-4) is a chemical compound with molecular formula C26H52N2O5S and molecular weight 504.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-ethyl-2-[(Z)-heptadec-8-enyl]-4,5-dihydroimidazol-1-ium-1-yl]ethanol;ethyl sulfate
Also Known As: EINECS 262-863-1, (Z)-1-Ethyl-2-(8-heptadecenyl)-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium ethyl sulphate, 1-(2-Hydroxyethyl)-1-ethyl-2-(8-heptadecenyl)-2-imidazolinium, cis-, ethosulfate, 1H-Imidazolium, 1-ethyl-2-((8Z)-8-heptadecen-1-yl)-4,5-dihydro-1-(2-hydroxyethyl)-, ethyl sulfate (1:1), 1H-Imidazolium, 1-ethyl-2-((8Z)-8-heptadecenyl)-4,5-dihydro-1-(2-hydroxyethyl)-, ethyl sulfate (salt)
| Molecular Formula | C26H52N2O5S |
|---|---|
| Molecular Weight | 504.36 g/mol |
| LogP | 5.7481 |
| Topological Polar Surface Area | 99.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 20 |
| Exact Mass | 504.35968 |
| Heavy Atoms | 34 |
| Complexity | 637.10223 |
Chemical Identifiers
| CAS Number | 61596-15-4 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC1=NCC[N+]1(CC)CCO.CCOS(=O)(=O)[O-] |
Product Overview
EINECS 262-863-1 (CAS 61596-15-4), with molecular formula C26H52N2O5S and molecular weight 504.36 g/mol. IUPAC: 2-[1-ethyl-2-[(Z)-heptadec-8-enyl]-4,5-dihydroimidazol-1-ium-1-yl]ethanol;ethyl sulfate.
Chemical Property Profile of EINECS 262-863-1
Property Insights of EINECS 262-863-1
The XLogP value of 5.7481 indicates that EINECS 262-863-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.02 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 262-863-1. Following Lipinski's Rule of Five, EINECS 262-863-1 has 1 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 EINECS 262-863-1?
The CAS number of EINECS 262-863-1 is 61596-15-4.
What is the molecular formula of EINECS 262-863-1?
The molecular formula of EINECS 262-863-1 is C26H52N2O5S.
What is the molecular weight of EINECS 262-863-1?
The molecular weight of EINECS 262-863-1 is 504.36 g/mol.
Where can I buy EINECS 262-863-1?
You can request a quote for EINECS 262-863-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 262-863-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 262-863-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.