ChemicalBook CAS DataBase List CyclohexylMethanethiol acetate

CyclohexylMethanethiol acetate synthesis

4synthesis methods

Product Name:CyclohexylMethanethiol acetate
CAS Number:107512-01-6
Molecular formula:C9H16OS
Molecular Weight:172.29

2550-36-9 Synthesis

2550-36-9
275 suppliers
$5.00/1g

10387-40-3 Synthesis

10387-40-3
358 suppliers
$10.00/1g

107512-01-6
7 suppliers
$653.30/1G

Yield:107512-01-6 97.68%

Reaction Conditions:

in N,N-dimethyl-formamide at 50; for 1 h;Inert atmosphere;

Steps:

14.1 Step 1 : S-cyclohexylmethyl ethanethioate

[00325] A solution of bromomethylcyclohexane (2.00 g, 11.29 mmol) and potassium ethanethioate (1.93 g, 16.93 mmol) in DMF (20.00 mL) was stirred at 50 °C for 1 h under N2 atmosphere. It was monitored by LC-MS. After completed, it was diluted with EtOAc, washed with brine, the organic layer was dried over magnesium sulfate, filtrated, concentrated to yield the crude product. It was purified by SGC to give S-(cyclohexylmethyl)ethanethioate (1.90 g, 11.03 mmol, 97.68%) as a yellow oil. ESI-MS (EI+, m/z): 173 [M+H]+. 1H MR (500 MHz, CDCb) δ 2.79 (d, 2H, J=9 Hz), 2.34 (s, 3H), 1.64-1.80 (m, 5H), 1.40-1.48 (m, 1H), 1.12-1.17 (m, 3H), 0.91-1.00 (m, 2H).

References:

WO2018/191146,2018,A1 Location in patent:Paragraph 00325

14100-97-1 Synthesis