Cholesteryl lignocerate

Base Information

• Chemical Name: Cholesteryl lignocerate
• CAS No.: 73024-96-1
• Molecular Formula: C₅₁H₉₂O₂
• Molecular Weight: 737.29
• UNII: 4HQM4PIN2X
• DSSTox Substance ID: DTXSID20993788
• Wikidata: Q27259607
• Metabolomics Workbench ID: 40923
• Mol file: 73024-96-1.mol

Synonyms:cholesteryl lignocerate;cholesteryl tetracosanoate

Chemical Property of Cholesteryl lignocerate

Chemical Property:

• Vapor Pressure: 3.63E-21mmHg at 25°C
• Boiling Point: 730°C at 760 mmHg
• Flash Point: 397°C
• PSA: 26.30000
• Density: 0.94g/cm³
• LogP: 16.54170
• XLogP3: 20.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 29
• Exact Mass: 736.70973217
• Heavy Atom Count: 53
• Complexity: 1030

Purity/Quality:

99% ^*data from raw suppliers

Cholesteryl Lignocerate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
• Isomeric SMILES: CCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C

Technology Process of Cholesteryl lignocerate

There total 2 articles about Cholesteryl lignocerate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

n-tetracosanoic acid (557-59-5) → O-tetracosanoyl-cholesterol (73024-96-1)

Guidance literature:

Multi-step reaction with 2 steps

1: SOCl₂

2: 90 °C

With thionyl chloride;

Reference yield:

tetracosanoyl chloride (58576-73-1) + cholesterol (57-88-5) → O-tetracosanoyl-cholesterol (73024-96-1)

Guidance literature:

at 90 ℃;

upstream raw materials:

tetracosanoyl chloride

cholesterol

n-tetracosanoic acid