1,2-dieicosanoyl-sn-glycero-3-phosphocholine
TL;DR: 1,2-dieicosanoyl-sn-glycero-3-phosphocholine (CAS 61596-53-0) is a chemical compound with molecular formula C48H97NO8P+ and molecular weight 846.70 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2R)-2,3-di(icosanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
Also Known As: 1,2-dieicosanoyl-sn-glycero-3-phosphocholine, (2R)-2,3-bis(icosanoyloxy)propoxy(2-(trimethylammonio)ethoxy)phosphinic acid, 2-[[(2R)-2,3-di(icosanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
| Molecular Formula | C48H97NO8P+ |
|---|---|
| Molecular Weight | 846.70 g/mol |
| LogP | 14.3646 |
| Topological Polar Surface Area | 108.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 46 |
| Exact Mass | 846.6952 |
| Heavy Atoms | 58 |
| Complexity | 958.49774 |
Chemical Identifiers
| CAS Number | 61596-53-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC |
Product Overview
1,2-dieicosanoyl-sn-glycero-3-phosphocholine (CAS 61596-53-0), with molecular formula C48H97NO8P+ and molecular weight 846.70 g/mol. IUPAC: 2-[[(2R)-2,3-di(icosanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium.
Chemical Property Profile of 1,2-dieicosanoyl-sn-glycero-3-phosphocholine
Property Insights of 1,2-dieicosanoyl-sn-glycero-3-phosphocholine
The XLogP value of 14.3646 indicates that 1,2-dieicosanoyl-sn-glycero-3-phosphocholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-dieicosanoyl-sn-glycero-3-phosphocholine. Following Lipinski's Rule of Five, 1,2-dieicosanoyl-sn-glycero-3-phosphocholine has 1 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 1,2-dieicosanoyl-sn-glycero-3-phosphocholine?
The CAS number of 1,2-dieicosanoyl-sn-glycero-3-phosphocholine is 61596-53-0.
What is the molecular formula of 1,2-dieicosanoyl-sn-glycero-3-phosphocholine?
The molecular formula of 1,2-dieicosanoyl-sn-glycero-3-phosphocholine is C48H97NO8P+.
What is the molecular weight of 1,2-dieicosanoyl-sn-glycero-3-phosphocholine?
The molecular weight of 1,2-dieicosanoyl-sn-glycero-3-phosphocholine is 846.70 g/mol.
Where can I buy 1,2-dieicosanoyl-sn-glycero-3-phosphocholine?
You can request a quote for 1,2-dieicosanoyl-sn-glycero-3-phosphocholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-dieicosanoyl-sn-glycero-3-phosphocholine?
Yes, KEHONG BIO provides custom synthesis services for 1,2-dieicosanoyl-sn-glycero-3-phosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.