1-Stearoyl-2-caprylphosphatidylcholine
TL;DR: 1-Stearoyl-2-caprylphosphatidylcholine (CAS 17511-04-5) is a chemical compound with molecular formula C36H72NO8P and molecular weight 677.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-decanoyloxy-3-octadecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: 1-Stearoyl-2-caprylphosphatidylcholine, C(18)-C(10)PC, 1-Octadecanoyl-2-decanoyl-sn-glycero-3-phosphocholine, (2-decanoyloxy-3-octadecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate, 3,5,9-Trioxa-4-phosphaheptacosan-1-aminium,4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxodecyl)oxy]-, inner salt, 4-oxide
| Molecular Formula | C36H72NO8P |
|---|---|
| Molecular Weight | 677.50 g/mol |
| LogP | 9.0514 |
| Topological Polar Surface Area | 111.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 34 |
| Exact Mass | 677.4996 |
| Heavy Atoms | 46 |
| Complexity | 773.59406 |
Chemical Identifiers
| CAS Number | 17511-04-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCC |
Product Overview
1-Stearoyl-2-caprylphosphatidylcholine (CAS 17511-04-5), with molecular formula C36H72NO8P and molecular weight 677.50 g/mol. IUPAC: (2-decanoyloxy-3-octadecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1-Stearoyl-2-caprylphosphatidylcholine
Property Insights of 1-Stearoyl-2-caprylphosphatidylcholine
The XLogP value of 9.0514 indicates that 1-Stearoyl-2-caprylphosphatidylcholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Stearoyl-2-caprylphosphatidylcholine. Following Lipinski's Rule of Five, 1-Stearoyl-2-caprylphosphatidylcholine 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 1-Stearoyl-2-caprylphosphatidylcholine?
The CAS number of 1-Stearoyl-2-caprylphosphatidylcholine is 17511-04-5.
What is the molecular formula of 1-Stearoyl-2-caprylphosphatidylcholine?
The molecular formula of 1-Stearoyl-2-caprylphosphatidylcholine is C36H72NO8P.
What is the molecular weight of 1-Stearoyl-2-caprylphosphatidylcholine?
The molecular weight of 1-Stearoyl-2-caprylphosphatidylcholine is 677.50 g/mol.
Where can I buy 1-Stearoyl-2-caprylphosphatidylcholine?
You can request a quote for 1-Stearoyl-2-caprylphosphatidylcholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Stearoyl-2-caprylphosphatidylcholine?
Yes, KEHONG BIO provides custom synthesis services for 1-Stearoyl-2-caprylphosphatidylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.