Cat.NO.:A516900 Purity:98%
Product Details of [ 100959-19-1 ]
| CAS No. : | 100959-19-1 |
| Formula : |
C7H16ClN |
| M.W : |
149.66
|
| SMILES Code : | NC1CCC(C)CC1.[H]Cl |
| MDL No. : | MFCD00051985 |
| InChI Key : | GIRKJSRZELQHDX-UHFFFAOYSA-N |
| Pubchem ID : | 12714125 |
Safety of [ 100959-19-1 ]
| GHS Pictogram: |  |
| Signal Word: | Warning |
| Hazard Statements: | H315-H319 |
| Precautionary Statements: | P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313 |
Application In Synthesis of [ 100959-19-1 ]
* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.
- Downstream synthetic route of [ 100959-19-1 ]
[ 100959-19-1 ] Synthesis Path-Downstream 1~1
- 1
[ 6624-49-3 ]
[ 100959-19-1 ]
[ 530-62-1 ]
[ 311346-55-1 ]
| Yield | Reaction Conditions | Operation in experiment |
|---|---|---|
| 377 mg (70%) | With N-ethyl-N,N-diisopropylamine; In N-methyl-acetamide; | Example 18 Preparation of N-(trans-4-methylcyclohexyl)isoquinoline-3-carboxamide (406) A solution of <strong>[6624-49-3]isoquinoline-3-carboxylic acid</strong> (346 mg, 2 mmol), and 1,1′-carbonyldiimidazole (325 mg, 2 mmol) in dimethylformamide (4 mL) was heated at 50° C. for 1 hour. After this time, trans-4-methylcyclohexylamine hydrochloride (300 mg, 2 mmol), and N,N-diisopropylethylamine (0.523 mL, 3 mmol) were added and the mixture heated at 50° C. for 16 hours. The reaction mixture was cooled, and diluted with ethyl acetate (20 mL). The organic solution was washed with water (3*15 mL), brine (20 mL), dried over anhydrous MgSO4, filtered and concentrated to afford 377 mg (70percent) of 406: rt=9.65 min.; m/z (rel. int.) 268 (M+, 9), 240 (6), 223 (16), 211 (17), 197 (13), 173 (22), 156 (55), 128 (100), 112 (38), 101 (15), 77 (10). |
References: [1]Patent: US6429207,2002,B1 .
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