Isobutyl 5-chloro-2,2-dimethylvalerate

Base Information

• Chemical Name: Isobutyl 5-chloro-2,2-dimethylvalerate
• CAS No.: 109232-37-3
• Molecular Formula: C11H21ClO2
• Molecular Weight: 220.74
• Hs Code.: 2915900090
• Mol file: 109232-37-3.mol

Synonyms:2-Methylpropyl5-chloro-2,2-dimethylpentanoate;

Chemical Property of Isobutyl 5-chloro-2,2-dimethylvalerate

Chemical Property:

• Appearance/Colour: Yellow brown liquid
• Vapor Pressure: 0.00864mmHg at 25°C
• Refractive Index: 1.441
• Boiling Point: 266.4 °C at 760 mmHg
• Flash Point: 115.1 °C
• PSA: 26.30000
• Density: 0.979 g/cm³
• LogP: 3.23080
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

Isobutyl5-Chloro-2,2-dimethylvalerate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Isobutyl 5-chloro-2,2-dimethylvalerate

There total 2 articles about Isobutyl 5-chloro-2,2-dimethylvalerate 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: 94.0%

isobutyl isobutanoate (97-85-8) + 1.3-chlorobromopropane (109-70-6) → 5-chloro-2,2-dimethylpentanoic acid isobutyl ester (109232-37-3)

Guidance literature:

isobutyl isobutanoate; With n-butyllithium; diisopropylamine; In hexane; cyclohexane; at 8 ℃; for 0.00222222h;

1.3-chlorobromopropane; In hexane; cyclohexane; at 7 ℃; for 0.00166667h; Solvent; Temperature;

Reference yield:

→ 5-chloro-2,2-dimethylpentanoic acid isobutyl ester (109232-37-3)

Guidance literature:

Reference yield: 95.0%

5-chloro-2,2-dimethylpentanoic acid isobutyl ester (109232-37-3) + 4-[(E)-2-(naphthalen-2-yl)ethenyl]phenol → isobutyl 2,2-dimethyl-5-{4-[(E)-2-(2-naphthyl)vinyl]phenoxy}pentanoate

Guidance literature:

4-[(E)-2-(naphthalen-2-yl)ethenyl]phenol; With potassium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 0.5h;

5-chloro-2,2-dimethylpentanoic acid isobutyl ester; In N,N-dimethyl-formamide; at 60 ℃;

DOI:10.1039/c5md00151j

upstream raw materials:

isobutyl isobutanoate

1.3-chlorobromopropane

Downstream raw materials:

isobutyl 2,2-dimethyl-5-(4-phenoxyphenoxy)pentanoate

isobutyl 5-(4-benzoylphenoxy)-2,2-dimethylpentanoate

isobutyl 2,2-dimetyl-5-{4-[(E)-phenyldiazenyl]phenoxy}pentanoate

C₂₉H₃₈O₇

Refernces

• 1、 Baker, Hannah,Ferreira, Liam D.,Gayler, Kevin M.,Kane, Robert R.,Karunananthan, Johann W.,Kostyo, Jessica H.,Martin, Emil,Mattke, Jordan,Nguyen, Harold,Plunk, Michael A.,Quintana, Jeremy M.,Sharina, Iraida,Shuda, Mina,Stinchcomb, Alexandra L.. "Gemfibrozil derivatives as activators of soluble guanylyl cyclase – A structure-activity study". . . Retrieved 2021/08/09.
• 2、 -. "Process for preparing 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid". . . Retrieved 2008/06/13.