Acetic acid, (phenylthio)-, 1,1-dimethylethyl ester

Base Information

• Chemical Name: Acetic acid, (phenylthio)-, 1,1-dimethylethyl ester
• CAS No.: 63006-68-8
• Molecular Formula: C12H16O2S
• Molecular Weight: 224.324
• Mol file: 63006-68-8.mol

Synonyms:Acetic acid,(phenylthio)-,1,1-dimethylethyl ester;tert-Butyl 2-(phenylsulfanyl)acetate;tert-Butyl (phenylsulfanyl)acetate;tert-Butyl 2-(Phenylsulfenyl)acetate;t-Butyl phenylthioacetate;tert-butyl(phenylthio)acetate;tert-butyl 2-(phenylthio)acetate;

Chemical Property of Acetic acid, (phenylthio)-, 1,1-dimethylethyl ester

Chemical Property:

• Boiling Point: 297.9±23.0 °C(Predicted)
• PSA: 51.60000
• Density: 1.08±0.1 g/cm3(Predicted)
• LogP: 3.12040

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Acetic acid, (phenylthio)-, 1,1-dimethylethyl ester

There total 10 articles about Acetic acid, (phenylthio)-, 1,1-dimethylethyl ester 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%

bromoacetic acid tert-butyl ester (5292-43-3) + thiophenol (108-98-5) → tert-butyl (phenylthio)acetate (63006-68-8)

Guidance literature:

With potassium tert-butylate; In tetrahydrofuran; Ambient temperature;

DOI:10.1021/jo00028a034

Reference yield: 95.0%

thiophenol (108-98-5) + t-butyl diazoacetate (35059-50-8) → tert-butyl (phenylthio)acetate (63006-68-8)

Guidance literature:

With sodium dithionite; L₂₉A H₆₄V sperm whale myoglobin; In aq. phosphate buffer; for 16h; pH=8; Catalytic behavior;

DOI:10.1039/c5sc00080g

Reference yield: 95.0%

→ tert-butyl (phenylthio)acetate (63006-68-8)

Guidance literature:

With sodium dithionite; In aq. buffer; for 16h; pH=8.0;

upstream raw materials:

bromoacetic acid tert-butyl ester

thiophenol

(phenylthio)acetic acid chloride

tert-butyl alcohol

Downstream raw materials:

(E)-2-Phenylsulfanyl-dec-4-enoic acid tert-butyl ester

tert.-Butyl(2-chloro-4-nitrophenyl)acetate

(2R,3R)-3-Hydroxy-5-methyl-2-phenylsulfanyl-hexanoic acid tert-butyl ester

(2R,3S)-3-Hydroxy-5-methyl-2-phenylsulfanyl-hexanoic acid tert-butyl ester