6-(3,5-DIMETHYLPHENYL)-6-OXOHEXANOIC ACID

Base Information

• Chemical Name: 6-(3,5-DIMETHYLPHENYL)-6-OXOHEXANOIC ACID
• CAS No.: 857481-29-9
• Molecular Formula: C14H18O3
• Molecular Weight: 234.29
• Hs Code.: 2918300090
• Mol file: 857481-29-9.mol

Synonyms:6-(3,5-DIMETHYLPHENYL)-6-OXOHEXANOIC ACID

Chemical Property of 6-(3,5-DIMETHYLPHENYL)-6-OXOHEXANOIC ACID

Chemical Property:

• Vapor Pressure: 6.76E-08mmHg at 25°C
• Boiling Point: 422.6°C at 760 mmHg
• Flash Point: 223.5°C
• PSA: 54.37000
• Density: 1.093g/cm³
• LogP: 3.13110

Purity/Quality:

97% ^*data from raw suppliers

6-(3,5-Dimethylphenyl)-6-oxohexanoicacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 6-(3,5-DIMETHYLPHENYL)-6-OXOHEXANOIC ACID

There total 4 articles about 6-(3,5-DIMETHYLPHENYL)-6-OXOHEXANOIC 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: 84.0%

2-(3,5-dimethylphenyl)cyclohexan-1-one (850663-18-2) → 6-(3,5-dimethylphenyl)-6-oxohexanoic acid (857481-29-9)

Guidance literature:

With hydrogenchloride; sodium nitrite; In tetrahydrofuran; water; at -5 - 20 ℃; for 6h;

DOI:10.1021/acs.orglett.1c02327

Reference yield:

1-(3,5-dimethylphenyl)cyclohexanol (854714-00-4) → 6-(3,5-dimethylphenyl)-6-oxohexanoic acid (857481-29-9)

Guidance literature:

With chromium(VI) oxide;

DOI:10.1021/ja01650a060

Reference yield:

3,5-dimethyphenylmagnesium bromide (34696-73-6) → 6-(3,5-dimethylphenyl)-6-oxohexanoic acid (857481-29-9)

Guidance literature:

Multi-step reaction with 2 steps

2: CrO₃

With chromium(VI) oxide;

DOI:10.1021/ja01650a060

upstream raw materials:

1-(3,5-dimethylphenyl)cyclohexanol

3,5-dimethyphenylmagnesium bromide

2-(3,5-dimethylphenyl)cyclohexan-1-one

3,5-dimethylphenyl boronic acid

Downstream raw materials:

6-(3,5-dimethyl-phenyl)-hexanoic acid

Refernces