1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate

Base Information

Chemical Name:1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate
CAS No.:1260236-99-4
Molecular Formula:C₁₆H₁₈O₆
Molecular Weight:308.293
Hs Code.:

1-benzyl 6-methyl [2-<sup>(13)</sup>C]-([1-<sup>(13)</sup>C]-2-acetyl)-3-oxohexanedioate

Synonyms:1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate

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Chemical Property of 1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate

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Technology Process of 1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate

There total 3 articles about 1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate 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: 73.3%

: benzyl [2,3-⁽¹³⁾C₂]-3-oxobutanoate

: 1490-25-1
succinic acid monomethylester chloride

: 1260236-99-4
1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate

Guidance literature:: benzyl [2,3-⁽¹³⁾C₂]-3-oxobutanoate; With pyridine; magnesium chloride; In dichloromethane; at 0 ℃; for 0.25h; Inert atmosphere;

succinic acid monomethylester chloride; In dichloromethane; at 0 - 20 ℃; Inert atmosphere;
DOI:10.1021/np100421v

Reference yield:

: 419542-67-9
(2-¹³C)benzyl acetate

: 1260236-99-4
1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate

Guidance literature:: Multi-step reaction with 2 steps

1.1: n-butyllithium; diisopropylamine / tetrahydrofuran; hexane / 0.75 h / -60 °C / Inert atmosphere

1.2: 0.83 h / -20 °C / Inert atmosphere

2.1: pyridine; magnesium chloride / dichloromethane / 0.25 h / 0 °C / Inert atmosphere

2.2: 0 - 20 °C / Inert atmosphere

With pyridine; n-butyllithium; diisopropylamine; magnesium chloride; In tetrahydrofuran; hexane; dichloromethane;
DOI:10.1021/np100421v

Reference yield:

: 100-39-0
benzyl bromide

: 1260236-99-4
1-benzyl 6-methyl [2-⁽¹³⁾C]-([1-⁽¹³⁾C]-2-acetyl)-3-oxohexanedioate

Guidance literature:: Multi-step reaction with 3 steps

1.1: N,N-dimethyl-formamide / 72 h / 96 °C / Inert atmosphere

2.1: n-butyllithium; diisopropylamine / tetrahydrofuran; hexane / 0.75 h / -60 °C / Inert atmosphere

2.2: 0.83 h / -20 °C / Inert atmosphere

3.1: pyridine; magnesium chloride / dichloromethane / 0.25 h / 0 °C / Inert atmosphere

3.2: 0 - 20 °C / Inert atmosphere

With pyridine; n-butyllithium; diisopropylamine; magnesium chloride; In tetrahydrofuran; hexane; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/np100421v