2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate
TL;DR: 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate (CAS 6542-05-8) is a chemical compound with molecular formula C44H80NO8P and molecular weight 781.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-di(octadeca-9,12-dienoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: Dilinoleoyllecithin, L-Dilinoleoyllecithin, 1,2-DILINOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2,3-bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate, 2,3-di(octadeca-9,12-dienoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
| Molecular Formula | C44H80NO8P |
|---|---|
| Molecular Weight | 781.56 g/mol |
| LogP | 12.4 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 40 |
| Exact Mass | 781.56213 |
| Heavy Atoms | 54 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 6542-05-8 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC |
| InChIKey | FVXDQWZBHIXIEJ-UHFFFAOYSA-N |
Product Overview
2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate (CAS 6542-05-8), with molecular formula C44H80NO8P and molecular weight 781.56 g/mol. IUPAC: 2,3-di(octadeca-9,12-dienoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate
Property Insights of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate
The XLogP value of 12.4 indicates that 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate. Following Lipinski's Rule of Five, 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate?
The CAS number of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate is 6542-05-8.
What is the molecular formula of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate?
The molecular formula of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate is C44H80NO8P.
What is the molecular weight of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate?
The molecular weight of 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate is 781.56 g/mol.
Where can I buy 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate?
You can request a quote for 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Bis(octadeca-9,12-dienoyloxy)propyl 2-(trimethylammonio)ethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.