3-(Fluoromethyl)-3,5-dihydroxypentanoic acid

Base Information

• Chemical Name: 3-(Fluoromethyl)-3,5-dihydroxypentanoic acid
• CAS No.: 1536-88-5
• Molecular Formula: C6H11FO4
• DSSTox Substance ID: DTXSID40439895
• Nikkaji Number: J861.237D

Synonyms:1536-88-5;3-(Fluoromethyl)-3,5-dihydroxypentanoic acid;DTXSID40439895;3,5-Dihydroxy-3-(fluoromethyl)valeric acid

Chemical Property of 3-(Fluoromethyl)-3,5-dihydroxypentanoic acid

Chemical Property:

• XLogP3: -1.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 166.06413699
• Heavy Atom Count: 11
• Complexity: 139

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CO)C(CC(=O)O)(CF)O

Technology Process of 3-(Fluoromethyl)-3,5-dihydroxypentanoic acid

There total 2 articles about 3-(Fluoromethyl)-3,5-dihydroxypentanoic acid 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:

dimethyl 3-fluoromethyl-3-hydroxyglutarate (757-66-4) → 3'-Fluor-DL-mevalonsaeure (1536-88-5)

Guidance literature:

Multistep reaction; (i) LiAlH₄, THF, Et₂O, (ii) NaBH₄, H₂O, (iii) aq. Ba(OH)2;

Reference yield:

→ 3'-Fluor-DL-mevalonsaeure (1536-88-5)

Guidance literature:

β-Hydroxy-β-fluormethyl-glutarsaeure-dimethylester, LiAlH4, NaBH4;

Reference yield:

3'-Fluor-DL-mevalonsaeure (1536-88-5) + benzylamine (100-46-9) → C13H18FNO3

Guidance literature:

In N,N-dimethyl-formamide; at 20 - 60 ℃; for 24h;

upstream raw materials:

dimethyl 3-fluoromethyl-3-hydroxyglutarate

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