Methyl 3-ethyl-3-hydroxypentanoate

Base Information

• Chemical Name: Methyl 3-ethyl-3-hydroxypentanoate
• CAS No.: 74126-51-5
• Molecular Formula: C8H16O3
• DSSTox Substance ID: DTXSID80503322
• Nikkaji Number: J2.323.010K
• Wikidata: Q82357040
• Mol file: 74126-51-5.mol

Synonyms:Methyl 3-ethyl-3-hydroxypentanoate;74126-51-5;DTXSID80503322

Chemical Property of Methyl 3-ethyl-3-hydroxypentanoate

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 160.109944368
• Heavy Atom Count: 11
• Complexity: 127

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC(CC)(CC(=O)OC)O

Technology Process of Methyl 3-ethyl-3-hydroxypentanoate

There total 1 articles about Methyl 3-ethyl-3-hydroxypentanoate 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:

3-ethyl-3-chloro-valeric acid methyl ester + water (7732-18-5) → methyl 3-ethyl-3-hydroxy-pentanoate (74126-51-5) + 3-Ethyl-2-pentenoic acid methyl ester (13979-17-4)

Guidance literature:

Reference yield:

methyl 3-ethyl-3-hydroxy-pentanoate (74126-51-5) → 3-Ethyl-2-pentenoic acid methyl ester (13979-17-4)

Guidance literature:

Multi-step reaction with 2 steps

1: CCl₄; PCl₅

2: NH₃; absolute ethanol / unter Kuehlung mit Eis-NaCl

With tetrachloromethane; ethanol; phosphorus pentachloride; ammonia;

Reference yield:

methyl 3-ethyl-3-hydroxy-pentanoate (74126-51-5) → 3-ethyl-3-hydroxy-valeric acid hydrazide (500794-56-9)

Guidance literature:

With hydrazine;

DOI:10.1021/ja01153a047

upstream raw materials:

water

Downstream raw materials:

3-ethyl-3-hydroxy-valeric acid hydrazide

3-Ethyl-2-pentenoic acid methyl ester