1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine
TL;DR: 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine (CAS 138852-22-9) is a chemical compound with molecular formula C29H60NO7P and molecular weight 565.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-acetyloxy-3-(2-methyloctadecoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: 2-Methyloctadecyl paf, 2-Methyl-C18-paf, 2-O-methyl-PAF C-18, 2-O-methyl-platelet-activating factor C-18, 1-o-2-o-acetyl-rac-glycero-3-phosphocholine
| Molecular Formula | C29H60NO7P |
|---|---|
| Molecular Weight | 565.41 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 28 |
| Exact Mass | 565.41077 |
| Heavy Atoms | 38 |
| Complexity | 604.0 |
Chemical Identifiers
| CAS Number | 138852-22-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCC(C)COCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C |
| InChIKey | CIVAIADZNGBFHP-UHFFFAOYSA-N |
Product Overview
1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine (CAS 138852-22-9), with molecular formula C29H60NO7P and molecular weight 565.41 g/mol. IUPAC: [2-acetyloxy-3-(2-methyloctadecoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine
Property Insights of 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine
The XLogP value of 8.0 indicates that 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-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-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine. Following Lipinski's Rule of Five, 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-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-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine?
The CAS number of 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine is 138852-22-9.
What is the molecular formula of 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine?
The molecular formula of 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine is C29H60NO7P.
What is the molecular weight of 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine?
The molecular weight of 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine is 565.41 g/mol.
Where can I buy 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine?
You can request a quote for 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-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-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine?
Yes, KEHONG BIO provides custom synthesis services for 1-O-(2-Methyloctadecyl)-2-O-acetyl-rac-glycero-3-phosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.