2-Methylbutyl 4-bromobenzoate

Base Information

• Chemical Name: 2-Methylbutyl 4-bromobenzoate
• CAS No.: 121051-36-3
• Molecular Formula: C₁₂H₁₅BrO₂
• Molecular Weight: 271.154
• DSSTox Substance ID: DTXSID10563070
• Mol file: 121051-36-3.mol

Synonyms:2-Methylbutyl 4-bromobenzoate;121051-36-3;DTXSID10563070;BIQDEPCHVKIHTG-UHFFFAOYSA-N;4-Bromobenzoic acid, 2-methylbutyl ester

Chemical Property of 2-Methylbutyl 4-bromobenzoate

Chemical Property:

• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 270.02554
• Heavy Atom Count: 15
• Complexity: 198

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)COC(=O)C1=CC=C(C=C1)Br

Technology Process of 2-Methylbutyl 4-bromobenzoate

There total 1 articles about 2-Methylbutyl 4-bromobenzoate 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:

(2S)-2-methyl-1-butanol (1565-80-6) + 4-Bromobenzoic acid (586-76-5) → 4-bromo-benzoic acid-(2-methyl-butyl ester) (121051-36-3)

Guidance literature:

With sulfuric acid; -ester;

upstream raw materials:

(2S)-2-methyl-1-butanol

4-Bromobenzoic acid