1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

Base Information

Chemical Name:1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane
CAS No.:119963-44-9
Molecular Formula:C₁₆H₁₉NO₃S
Molecular Weight:305.398
Hs Code.:

Synonyms:1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

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Technology Process of 1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

There total 5 articles about 1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane 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: 58.0%

: 463-71-8
thiophosgene

: 119963-48-3
1-(m-aminophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

: 119963-44-9
1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

Guidance literature:: With potassium carbonate; In chloroform; water; pentane; for 0.333333h;
DOI:10.1021/jm00109a002

Reference yield:

: 99250-47-2
3-t-butyl-3-hydroxymethyl-oxetane

: 119963-44-9
1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

Guidance literature:: Multi-step reaction with 4 steps

1: 81 percent / Et₃N / tetrahydrofuran / 1 h / Ambient temperature

2: 45 percent / BF₃*Et₂O / CH₂Cl₂ / 12 h / Ambient temperature

3: 91 percent / H₂ / 5percent Pd/BaSO₄ / ethanol / 0.33 h / 760 Torr / Ambient temperature

4: 58 percent / K₂CO₃ / pentane; CHCl₃; H₂O / 0.33 h

With boron trifluoride diethyl etherate; hydrogen; potassium carbonate; triethylamine; Pd-BaSO₄; In tetrahydrofuran; ethanol; dichloromethane; chloroform; water; pentane;
DOI:10.1021/jm00109a002

Reference yield:

: 132981-24-9
3-<<(m-nitrobenzoyl)oxy>methyl>-3-tert-butyloxetane

: 119963-44-9
1-(m-isothiocyanatophenyl)-4-tert-butyl-2,6,7-trioxabicyclo<2.2.2>octane

Guidance literature:: Multi-step reaction with 3 steps

1: 45 percent / BF₃*Et₂O / CH₂Cl₂ / 12 h / Ambient temperature

2: 91 percent / H₂ / 5percent Pd/BaSO₄ / ethanol / 0.33 h / 760 Torr / Ambient temperature

3: 58 percent / K₂CO₃ / pentane; CHCl₃; H₂O / 0.33 h

With boron trifluoride diethyl etherate; hydrogen; potassium carbonate; Pd-BaSO₄; In ethanol; dichloromethane; chloroform; water; pentane;
DOI:10.1021/jm00109a002