<1-13C>-4-Phenylbutyric acid

Base Information

• Chemical Name: <1-13C>-4-Phenylbutyric acid
• CAS No.: 59616-73-8
• Molecular Formula: C₁₀H₁₂O₂
• Molecular Weight: 165.193
• Mol file: 59616-73-8.mol

Synonyms:<1-13C>-4-Phenylbutyric acid

Chemical Property of <1-13C>-4-Phenylbutyric acid

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of <1-13C>-4-Phenylbutyric acid

There total 6 articles about <1-13C>-4-Phenylbutyric 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: 95.0%

[1-13C]-4-Phenylbutyronitrile (166111-39-3) → <1-13C>-4-Phenylbutyric acid (59616-73-8)

Guidance literature:

With hydrogenchloride; for 8h; Heating;

DOI:10.1021/jo00114a018

Reference yield: 34.0%

1-iodo-3-phenylpropan (4119-41-9) + [13C]Carbon monoxide (1641-69-6) → <1-13C>-4-Phenylbutyric acid (59616-73-8)

Guidance literature:

With dimethyl sulfoxide; triethylamine; In tetrahydrofuran; at 35 ℃; for 0.1h; under 300030 Torr; UV-irradiation;

Reference yield:

allylbenzene (300-57-2,57807-91-7) + 13C-TFBen → <1-13C>-4-Phenylbutyric acid (59616-73-8) + C9(13)CH12O2 + C9(13)CH12O2

Guidance literature:

With formic acid; bis[chloro(1,2,3-trihapto-allylbenzene)palladium(II)]; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In tetrahydrofuran; at 100 ℃; Overall yield = 71 %; Inert atmosphere; Sealed tube;

DOI:10.1021/acs.orglett.9b02047

upstream raw materials:

[1-13C]-4-Phenylbutyronitrile

1-iodo-3-phenylpropan

[13C]Carbon monoxide

phenylbutyric acid chloride

Refernces

• 1、 Wu, Fu-Peng,Li, Da,Peng, Jin-Bao,Wu, Xiao-Feng. "Carbonylative Transformation of Allylarenes with CO Surrogates: Tunable Synthesis of 4-Arylbutanoic Acids, 2-Arylbutanoic Acids, and 4-Arylbutanals". supporting information. p. 5699 - 5703. Retrieved 2019/08/01.
• 2、 -. "Method for the use of [11C] carbon monoxide in labeling synthesis of 11C-labelled acids by photo-induced free radical carbonylation". Page/Page column 17-18. . Retrieved 2010/03/05.