(2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate
TL;DR: (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate (CAS 139574-76-8) is a chemical compound with molecular formula C28H52NO6P and molecular weight 529.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-3-hexadecoxypropyl) 2-pyridin-1-ium-1-ylethyl phosphate
Also Known As: Phosphoether lipid, rac-1-O-Hexadecyl-2-O-ethylglycero-3-phospho-2-pyridinumethanol, (2-ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate, (2-ethoxy-3-hexadecoxypropyl) 2-pyridin-1-ium-1-ylethyl phosphate, Pyridinium, 1-(7-ethoxy-4-hydroxy-4-oxido-3,5,9-trioxa-4-phosphapentacos-1-yl)-, inner salt
| Molecular Formula | C28H52NO6P |
|---|---|
| Molecular Weight | 529.35 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 26 |
| Exact Mass | 529.3532 |
| Heavy Atoms | 36 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 139574-76-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+]1=CC=CC=C1)OCC |
| InChIKey | FKZOZUJSNCSNBZ-UHFFFAOYSA-N |
Product Overview
(2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate (CAS 139574-76-8), with molecular formula C28H52NO6P and molecular weight 529.35 g/mol. IUPAC: (2-ethoxy-3-hexadecoxypropyl) 2-pyridin-1-ium-1-ylethyl phosphate.
Chemical Property Profile of (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate
Property Insights of (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate
The XLogP value of 7.5 indicates that (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate. Following Lipinski's Rule of Five, (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate has 0 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 (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate?
The CAS number of (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate is 139574-76-8.
What is the molecular formula of (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate?
The molecular formula of (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate is C28H52NO6P.
What is the molecular weight of (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate?
The molecular weight of (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate is 529.35 g/mol.
Where can I buy (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate?
You can request a quote for (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for (2-Ethoxy-3-hexadecoxy-propyl) 2-pyridin-1-ium-1-ylethyl hydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.