Cholesteryl methyl carbonate

Base Information

• Chemical Name: Cholesteryl methyl carbonate
• CAS No.: 15507-52-5
• Molecular Formula: C₂₉H₄₈O₃
• Molecular Weight: 444.698
• NSC Number: 93985
• Nikkaji Number: J48.403B
• Mol file: 15507-52-5.mol

Synonyms:Cholesteryl methyl carbonate;Cholesterol Methyl Carbonate;15507-52-5;Cholest-5-en-3-ol (3.beta.)-, methyl carbonate;[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] methyl carbonate;Carbonic acid, cholesteryl methyl ester;Cholesterol, methyl carbonate;NSC93985;SCHEMBL249326;MFCD00021136;NSC-93985;Cholesterol carbonic acid methyl ester;AKOS027320396;Methyl Carbonic Acid Cholesterol Ester;9H-Xanthen-9-one, 2-(1-methylethyl)-;Cholest-5-en-3.beta.-yl-methyl carbonate;CS-0183052;Cholest-5-en-3-ol (3|A)-, 3-(methyl carbonate);WLN: L E5 B666 LUTJ A1 E1 FY1&3Y1&1 OOVO1;(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl methyl carbonate

Chemical Property of Cholesteryl methyl carbonate

Chemical Property:

• Vapor Pressure: 3.35E-11mmHg at 25°C
• Melting Point: 114 °C
• Refractive Index: 1.515
• Boiling Point: 527.1 °C at 760 mmHg
• Flash Point: 139.9 °C
• PSA: 35.53000
• Density: 1.02 g/cm³
• LogP: 8.17940
• Storage Temp.: −20°C
• XLogP3: 9.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 444.36034539
• Heavy Atom Count: 32
• Complexity: 711

Purity/Quality:

98%,99%, ^*data from raw suppliers

CHOLESTERYL METHYL CARBONATE ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)OC)C)C
• Isomeric SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OC)C)C

Technology Process of Cholesteryl methyl carbonate

There total 2 articles about Cholesteryl methyl carbonate 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:

cholesterol (57-88-5) + methyl chloroformate (79-22-1) → cholesteryl methyl carbonate (15507-52-5)

Guidance literature:

With pyridine; benzene;

Reference yield:

→ Cholesteryl-methylcarbonat (15507-52-5)

Guidance literature:

Aus Cholesterylchloroformat u. Methanol/Pyridin;

upstream raw materials:

cholesterol

methyl chloroformate