1,2-Isostearoylphosphatidylcholine
TL;DR: 1,2-Isostearoylphosphatidylcholine (CAS 58045-79-7) is a chemical compound with molecular formula C44H88NO8P and molecular weight 789.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis(16-methylheptadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: DiSPC, 1,2-Isostearoylphosphatidylcholine, 1,2-Isostearoyl-sn-glycero-3-phosphocholine, 2,3-bis(16-methylheptadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate, 3,5,9-Trioxa-4-phosphahexacosan-1-aminium, 4-hydroxy-N,N,N,25-tetramethyl-7-((16-methyl-1-oxoheptadecyl)oxy)-10-oxo-, hydroxide, inner salt, 4-oxide
| Molecular Formula | C44H88NO8P |
|---|---|
| Molecular Weight | 789.62 g/mol |
| LogP | 11.884 |
| Topological Polar Surface Area | 111.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 40 |
| Exact Mass | 789.62476 |
| Heavy Atoms | 54 |
| Complexity | 922.75354 |
Chemical Identifiers
| CAS Number | 58045-79-7 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC(C)C |
Product Overview
1,2-Isostearoylphosphatidylcholine (CAS 58045-79-7), with molecular formula C44H88NO8P and molecular weight 789.62 g/mol. IUPAC: 2,3-bis(16-methylheptadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1,2-Isostearoylphosphatidylcholine
Property Insights of 1,2-Isostearoylphosphatidylcholine
The XLogP value of 11.884 indicates that 1,2-Isostearoylphosphatidylcholine 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 1,2-Isostearoylphosphatidylcholine. Following Lipinski's Rule of Five, 1,2-Isostearoylphosphatidylcholine 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 1,2-Isostearoylphosphatidylcholine?
The CAS number of 1,2-Isostearoylphosphatidylcholine is 58045-79-7.
What is the molecular formula of 1,2-Isostearoylphosphatidylcholine?
The molecular formula of 1,2-Isostearoylphosphatidylcholine is C44H88NO8P.
What is the molecular weight of 1,2-Isostearoylphosphatidylcholine?
The molecular weight of 1,2-Isostearoylphosphatidylcholine is 789.62 g/mol.
Where can I buy 1,2-Isostearoylphosphatidylcholine?
You can request a quote for 1,2-Isostearoylphosphatidylcholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Isostearoylphosphatidylcholine?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Isostearoylphosphatidylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.