Octanethioic acid

Base Information

• Chemical Name: Octanethioic acid
• CAS No.: 7530-92-9
• Molecular Formula: C8H16OS
• Molecular Weight: 160.28
• Mol file: 7530-92-9.mol

Synonyms:thiocaprylic acid;thiooctanoic acid;n-thiooctanoic acid;Thiooctansaeure;Octanethioic acid;thiooctanoic S-acid;

Chemical Property of Octanethioic acid

Chemical Property:

• Boiling Point: 95-96℃ (3 Torr)
• Flash Point: 87.5±18.7℃
• PSA: 55.87000
• Density: 0.933±0.06 g/cm3 (20 oC 760 Torr)
• LogP: 2.80330

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Octanethioic acid

There total 5 articles about Octanethioic 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: 90.0%

n-octanoic acid chloride (111-64-8) → octanethioic S-acid (7530-92-9)

Guidance literature:

n-octanoic acid chloride; With thioacetamide; In benzene; at 30 ℃; for 4h; Inert atmosphere;

With sodium hydroxide; In water; benzene; at 20 ℃; for 0.5h;

DOI:10.1021/acs.oprd.7b00352

Reference yield: 80.0%

thioacetamide (62-55-5) + n-octanoic acid chloride (111-64-8) → octanethioic S-acid (7530-92-9)

Guidance literature:

thioacetamide; n-octanoic acid chloride; In benzene; at 30 ℃; for 3h;

With sodium hydroxide; In benzene; at 20 ℃; for 0.5h;

DOI:10.1080/10426500307837

Reference yield:

C10H19NOS*ClH → octanethioic S-acid (7530-92-9)

Guidance literature:

C₁₀H₁₉NOS*ClH; With sodium hydroxide; In benzene; for 0.5h; Inert atmosphere;

With potassium hydrogensulfate; In benzene; Inert atmosphere;

DOI:10.1002/anie.200802043

upstream raw materials:

n-octanoic acid chloride

thioacetamide

Octanoic acid

Downstream raw materials:

cyclohexanethiooctanoate

5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate

N-benzyloctanoic amide

largazole

Refernces

• 1、 Mali, Sachitanand M.,Bhaisare, Rupal D.,Gopi, Hosahudya N.. "Thioacids mediated selective and mild N-acylation of amines". . p. 5550 - 5555. Retrieved 2013/07/25.
• 2、 Seiser, Tobias,Kamena, Faustin,Cramer, Nicolai. "Synthesis and biological activity of largazole and derivatives". supporting information; experimental part. p. 6483 - 6485. Retrieved 2009/03/11.