Reaction #4104974
Related Literature (1)
openreactiondata ↗doi:10.1039/C8SC04228D
Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-9e6f428d07a544f08f16c6888267767eNo renderable structure data available
CC(C)OC(=O)NC1=CC=CC=C1Chemical Intermediate
Structures, identifiers and computed properties have been matched to the database record by CAS.
| Intermediates | propan-2-yl N-phenylcarbamate |
|---|---|
| IUPAC Name | — |
| CAS Number | 122-42-9 |
| Database ID | 24685 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
propan-2-yl N-phenylcarbamate (CAS 122-42-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
Potential Applications
For professional research and industrial use only
Database ID 24685
Safety Notice
For professional research and industrial use only. Review the supplier safety data sheet before handling.
Synthesis data
12 reactions · 12 references
Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-9e6f428d07a544f08f16c6888267767eConditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-ad93be31c55a479a8967da7a5741b434Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-1d04f9c9060d45eb8e44bbd6754792a2Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: A liquid mixture of 50 g (0.42 mol) of phenyl isocyanate and 6.43 ml (0.084 mol) of isopropanol was stirred at room temperature for 20 minutes and thereafter an unreacted raw material was distilled away under a reduced pressure to obtain 16.1% of isopropyl N-phenylcarbamate. an unreacted raw material was distilled away under a reduced pressure
Source ID: ord-f59c654b12d643fd941585620047729cConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: A liquid mixture of 50 g (0.42 mol) of phenyl isocyanate and 6.43 ml (0.084 mol) of isopropanol was stirred at room temperature for 20 minutes and thereafter an unreacted raw material was distilled away under a reduced pressure to obtain 16.1% of isopropyl N-phenylcarbamate. an unreacted raw material was distilled away under a reduced pressure
Source ID: ord-f59c654b12d643fd941585620047729cConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: Eighteen grams isopropyl phenylcarbamate (~0.1 mol) and 14.0 g thionyl chloride (0.12 mol) were dissolved in 50 ml dry tetrahydrofuran and protected from moisture by a calcium chloride tube. Eight grams pyridine (0.1 mol) were added dropwise while the mixture was stirring at a water bath temperature (15°-20° C.). After the addition of pyridine was completed, the mixture was stirred for 12 hours at room temperature. Pyridine hydrochloride was filtered and the solvent was removed under vacuum. The concentrated residue was diluted with hexane and filtered. The hexane was removed under vacuum and the residue was distilled, giving 16.0 g of product distilling at 113-115/0.08 mm. NMR spectrum of the product in chloroform-d-TMS gave the following absorptions: δ7.6-7.2 (m, 5H, phenyl protons), δ5.5-4.9 (m, 1H, CH) and δ1.4-1.3 (d, 6H, C(CH3)2). protected from moisture by a calcium chloride tube the mixture was stirred for 12 hours at room temperature Pyridine hydrochloride was filtered the solvent was removed under vacuum The concentrated residue was diluted with hexane filtered The hexane was removed under vacuum the residue was distilled
Source ID: ord-bf312fb42f2541cb8fb0654ff628516aConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: Eighteen grams isopropyl phenylcarbamate (~0.1 mol) and 14.0 g thionyl chloride (0.12 mol) were dissolved in 50 ml dry tetrahydrofuran and protected from moisture by a calcium chloride tube. Eight grams pyridine (0.1 mol) were added dropwise while the mixture was stirring at a water bath temperature (15°-20° C.). After the addition of pyridine was completed, the mixture was stirred for 12 hours at room temperature. Pyridine hydrochloride was filtered and the solvent was removed under vacuum. The concentrated residue was diluted with hexane and filtered. The hexane was removed under vacuum and the residue was distilled, giving 16.0 g of product distilling at 113-115/0.08 mm. NMR spectrum of the product in chloroform-d-TMS gave the following absorptions: δ7.6-7.2 (m, 5H, phenyl protons), δ5.5-4.9 (m, 1H, CH) and δ1.4-1.3 (d, 6H, C(CH3)2). protected from moisture by a calcium chloride tube the mixture was stirred for 12 hours at room temperature Pyridine hydrochloride was filtered the solvent was removed under vacuum The concentrated residue was diluted with hexane filtered The hexane was removed under vacuum the residue was distilled
Source ID: ord-bf312fb42f2541cb8fb0654ff628516aConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: A liquid mixture of 50 g (0.42 mol) of phenyl isocyanate and 6.43 ml (0.084 mol) of isopropanol was stirred at room temperature for 20 minutes and thereafter an unreacted raw material was distilled away under a reduced pressure to obtain 16.1% of isopropyl N-phenylcarbamate. an unreacted raw material was distilled away under a reduced pressure
Source ID: ord-f59c654b12d643fd941585620047729cConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: Eighteen grams isopropyl phenylcarbamate (~0.1 mol) and 14.0 g thionyl chloride (0.12 mol) were dissolved in 50 ml dry tetrahydrofuran and protected from moisture by a calcium chloride tube. Eight grams pyridine (0.1 mol) were added dropwise while the mixture was stirring at a water bath temperature (15°-20° C.). After the addition of pyridine was completed, the mixture was stirred for 12 hours at room temperature. Pyridine hydrochloride was filtered and the solvent was removed under vacuum. The concentrated residue was diluted with hexane and filtered. The hexane was removed under vacuum and the residue was distilled, giving 16.0 g of product distilling at 113-115/0.08 mm. NMR spectrum of the product in chloroform-d-TMS gave the following absorptions: δ7.6-7.2 (m, 5H, phenyl protons), δ5.5-4.9 (m, 1H, CH) and δ1.4-1.3 (d, 6H, C(CH3)2). protected from moisture by a calcium chloride tube the mixture was stirred for 12 hours at room temperature Pyridine hydrochloride was filtered the solvent was removed under vacuum The concentrated residue was diluted with hexane filtered The hexane was removed under vacuum the residue was distilled
Source ID: ord-1adfba7e948e4a2b8e8f9fdab38eeae1Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-9e6f428d07a544f08f16c6888267767eConditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-ad93be31c55a479a8967da7a5741b434Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-1d04f9c9060d45eb8e44bbd6754792a2PubChem References
These sources are listed in the compound's public database record.
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