25-Fluoro-1alpha-hydroxyvitamin D3/25-fluoro-1alpha-hydroxycholecalciferol

Base Information

• Chemical Name: 25-Fluoro-1alpha-hydroxyvitamin D3/25-fluoro-1alpha-hydroxycholecalciferol
• CAS No.: 64164-40-5
• Molecular Formula: C27H43 F O2
• Molecular Weight: 418.63
• Metabolomics Workbench ID: 35757
• Mol file: 64164-40-5.mol

Synonyms:1 alpha-hydroxy-25-fluorovitamin D3;1-hydroxy-25-fluorovitamin D3

Chemical Property of 25-Fluoro-1alpha-hydroxyvitamin D3/25-fluoro-1alpha-hydroxycholecalciferol

Chemical Property:

• Vapor Pressure: 6.13E-14mmHg at 25°C
• Boiling Point: 540.5°C at 760 mmHg
• Flash Point: 280.7°C
• PSA: 40.46000
• Density: 1.04g/cm³
• LogP: 6.68190
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 418.32470877
• Heavy Atom Count: 30
• Complexity: 691

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCCC(C)(C)F)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C
• Isomeric SMILES: C[C@H](CCCC(C)(C)F)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C

Technology Process of 25-Fluoro-1alpha-hydroxyvitamin D3/25-fluoro-1alpha-hydroxycholecalciferol

There total 1 articles about 25-Fluoro-1alpha-hydroxyvitamin D3/25-fluoro-1alpha-hydroxycholecalciferol 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:

aqueous potassium hydroxide + 1α-acetoxy-25-fluorocholecalciferol acetate → 25-fluoro-1α-hydroxycholecalciferol (64164-40-5)

Guidance literature:

In methanol;

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