HEPTANOIC-7,7,7-D3 ACID

Base Information

• Chemical Name: HEPTANOIC-7,7,7-D3 ACID
• CAS No.: 156779-04-3
• Molecular Formula: C₇H₁₄O₂
• Molecular Weight: 143.084
• Mol file: 156779-04-3.mol

Synonyms:HEPTANOIC-7,7,7-D3 ACID

Chemical Property of HEPTANOIC-7,7,7-D3 ACID

Chemical Property:

• PSA: 37.30000
• LogP: 2.04140

Purity/Quality:

99%, ^*data from raw suppliers

Heptanoic-7,7,7-d3Acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: Heptanoic-7,7,7-d3 Acid (CAS# 156779-04-3) is a useful isotopically labeled research compound.

Technology Process of HEPTANOIC-7,7,7-D3 ACID

There total 3 articles about HEPTANOIC-7,7,7-D3 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: 100.0%

2,2-dimethyl-n-valeric acid (1185-39-3) → <2H13>heptanoic acid (156779-04-3,130348-93-5,352431-36-8)

Guidance literature:

2,2-dimethyl-n-valeric acid; With 10% Pt/activated carbon; water-d2; In isopropyl alcohol; at 120 ℃; for 24h;

With water; sodium hydroxide; at 70 ℃; for 24h; Solvent;

DOI:10.1002/adsc.201600363

Reference yield:

methyl 3-chloro-5,6-dibromothieno<3,2,b>thiophene-2-carboxylate (160847-34-7) → <2H13>heptanoic acid (156779-04-3,130348-93-5,352431-36-8)

Guidance literature:

With deuteriated sodium hydroxide; aluminum nickel; water-d2; Multistep reaction; 1.) THF, 90 deg C, 10 min, 3.) THF, 90 deg C, 2 h;

DOI:10.1002/jlcr.2580341112

Reference yield:

5,6-Dibromo-3-chloro-thieno[3,2-b]thiophene-2-carbonyl chloride → <2H13>heptanoic acid (156779-04-3,130348-93-5,352431-36-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 1 h / Heating

2: 1.) NaOD, D₂O, 2.) Ni-Al / 1.) THF, 90 deg C, 10 min, 3.) THF, 90 deg C, 2 h

With deuteriated sodium hydroxide; aluminum nickel; water-d2;

DOI:10.1002/jlcr.2580341112

upstream raw materials:

methyl 3-chloro-5,6-dibromothieno<3,2,b>thiophene-2-carboxylate

2,2-dimethyl-n-valeric acid