EINECS 238-307-9
TL;DR: EINECS 238-307-9 (CAS 14350-98-2) is a chemical compound with molecular formula C25H51N2NaO6S and molecular weight 530.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-hydroxypropane-1-sulfonate;hydroxide
Also Known As: Sodium 2-heptadecyl-4,5-dihydro-1-(2-hydroxyethyl)-1-(2-hydroxy-3-sulphonatopropyl)-1H-imidazolium hydroxide, 1h-imidazolium, 2-heptadecyl-4,5-dihydro-1-(2-hydroxyethyl)-1-(2-hydroxy-3-sulfopropyl)-,inner salt, sodium salt, hydrate(1:1:1), Sodium 2-heptadecyl-4,5-dihydro-1-(2-hydroxyethyl)-1-(2-hydroxy-3-sulfonatopropyl)-1H-imidazolium hydroxide, 2-Imidazolinium, 2-heptadecyl-1-(2-hydroxyethyl)(2-hydroxy-3-sulfopropyl)-, hydroxide, monosodium salt, sodium 3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-hydroxypropane-1-sulfonate hydroxide
| Molecular Formula | C25H51N2NaO6S |
|---|---|
| Molecular Weight | 530.34 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 21 |
| Exact Mass | 530.33655 |
| Heavy Atoms | 35 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 14350-98-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC(CS(=O)(=O)[O-])O.[OH-].[Na+] |
| InChIKey | FKHUODNVGOLIJR-UHFFFAOYSA-M |
Product Overview
EINECS 238-307-9 (CAS 14350-98-2), with molecular formula C25H51N2NaO6S and molecular weight 530.34 g/mol. IUPAC: sodium;3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-hydroxypropane-1-sulfonate;hydroxide.
Chemical Property Profile of EINECS 238-307-9
Property Insights of EINECS 238-307-9
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 238-307-9. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 238-307-9. Following Lipinski's Rule of Five, EINECS 238-307-9 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 238-307-9?
The CAS number of EINECS 238-307-9 is 14350-98-2.
What is the molecular formula of EINECS 238-307-9?
The molecular formula of EINECS 238-307-9 is C25H51N2NaO6S.
What is the molecular weight of EINECS 238-307-9?
The molecular weight of EINECS 238-307-9 is 530.34 g/mol.
Where can I buy EINECS 238-307-9?
You can request a quote for EINECS 238-307-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 238-307-9?
Yes, KEHONG BIO provides custom synthesis services for EINECS 238-307-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.