1-O-docosyl-2-O-acetylglycero-3-phosphocholine
TL;DR: 1-O-docosyl-2-O-acetylglycero-3-phosphocholine (CAS 126372-87-0) is a chemical compound with molecular formula C32H66NO7P and molecular weight 607.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetyloxy-3-docosoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: 1-Dagpc, 1-O-Docosyl-2-O-acetylglycero-3-phosphocholine, PC O-22:0_2:0, (2-acetyloxy-3-docosoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate, 2-(Acetyloxy)-3-(docosyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
| Molecular Formula | C32H66NO7P |
|---|---|
| Molecular Weight | 607.46 g/mol |
| LogP | 9.8 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 32 |
| Exact Mass | 607.4577 |
| Heavy Atoms | 41 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 126372-87-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C |
| InChIKey | VWHZXCKKLJTHOV-UHFFFAOYSA-N |
Product Overview
1-O-docosyl-2-O-acetylglycero-3-phosphocholine (CAS 126372-87-0), with molecular formula C32H66NO7P and molecular weight 607.46 g/mol. IUPAC: (2-acetyloxy-3-docosoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1-O-docosyl-2-O-acetylglycero-3-phosphocholine
Property Insights of 1-O-docosyl-2-O-acetylglycero-3-phosphocholine
The XLogP value of 9.8 indicates that 1-O-docosyl-2-O-acetylglycero-3-phosphocholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-O-docosyl-2-O-acetylglycero-3-phosphocholine. Following Lipinski's Rule of Five, 1-O-docosyl-2-O-acetylglycero-3-phosphocholine has 0 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-O-docosyl-2-O-acetylglycero-3-phosphocholine?
The CAS number of 1-O-docosyl-2-O-acetylglycero-3-phosphocholine is 126372-87-0.
What is the molecular formula of 1-O-docosyl-2-O-acetylglycero-3-phosphocholine?
The molecular formula of 1-O-docosyl-2-O-acetylglycero-3-phosphocholine is C32H66NO7P.
What is the molecular weight of 1-O-docosyl-2-O-acetylglycero-3-phosphocholine?
The molecular weight of 1-O-docosyl-2-O-acetylglycero-3-phosphocholine is 607.46 g/mol.
Where can I buy 1-O-docosyl-2-O-acetylglycero-3-phosphocholine?
You can request a quote for 1-O-docosyl-2-O-acetylglycero-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-O-docosyl-2-O-acetylglycero-3-phosphocholine?
Yes, KEHONG BIO provides custom synthesis services for 1-O-docosyl-2-O-acetylglycero-3-phosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.