No renderable structure data available
CCOC(=O)CNC(=O)NNC(=O)C1=CC=C(C=C1)ClChemical Intermediate
Structures, identifiers and computed properties have been matched to the database record by CAS.
| Intermediates | ethyl 2-[[(4-chlorobenzoyl)amino]carbamoylamino]acetate |
|---|---|
| IUPAC Name | — |
| CAS Number | 1228650-21-2 |
| Database ID | 59536829 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
ethyl 2-[[(4-chlorobenzoyl)amino]carbamoylamino]acetate (CAS 1228650-21-2) 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 59536829
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-3be82e822b9645a2840d7f5f8f18502fConditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-3be82e822b9645a2840d7f5f8f18502fConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 91 ml of 3 N aqueous sodium hydroxide solution were added to 21.43 g (67.9 mmol) of the compound from Example 1A, and the mixture was heated under reflux overnight. After cooling to RT, the mixture was adjusted to pH 1 by slow addition of about 20% strength hydrochloric acid. The precipitated solid was isolated by filtration, washed with water and dried at 60° C. under reduced pressure. This gave 17.55 g of the title compound in a purity of about 88% (90% of theory). the mixture was heated under reflux overnight The precipitated solid was isolated by filtration washed with water dried at 60° C. under reduced pressure
Source ID: ord-061991a0ac4a46e2b033b708c0203f8bConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 91 ml of 3 N aqueous sodium hydroxide solution were added to 21.43 g (67.9 mmol) of the compound from Example 1A, and the mixture was heated under reflux overnight. After cooling to RT, the mixture was adjusted to pH 1 by slow addition of about 20% strength hydrochloric acid. The precipitated solid was isolated by filtration, washed with water and dried at 60° C. under reduced pressure. This gave 17.55 g of the title compound in a purity of about 88% (90% of theory). the mixture was heated under reflux overnight The precipitated solid was isolated by filtration washed with water dried at 60° C. under reduced pressure
Source ID: ord-061991a0ac4a46e2b033b708c0203f8bConditions: temp:50.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: A suspension of 12.95 g (75.9 mmol) of 4-chlorobenzohydrazide in 50 ml of dry THF was initially charged at 50° C., and a solution of 10.0 g (77.5 mmol) of ethyl 2-isocyanatoacetate in 100 ml of dry THF was added dropwise. Initially, a solution was obtained, and then a precipitate formed. After the addition had ended, the mixture was stirred at 50° C. for a further 2 h and then allowed to stand at RT overnight. The crystals were isolated by filtration, washed with a little diethyl ether and dried under high vacuum. This gave 21.43 g (89% of theory) of the title compound. was initially charged at 50° C. Initially, a solution was obtained a precipitate formed After the addition to stand at RT overnight The crystals were isolated by filtration washed with a little diethyl ether dried under high vacuum
Source ID: ord-93285e2e3aff4595965ec1b43189b7e5Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 91 ml of a 3N aqueous sodium hydroxide solution were added to 21.43 g (67.9 mmol) of the compound of Example 1A, and the mixture was heated at reflux overnight. After cooling to RT, the mixture was adjusted to pH 1 by slow addition of about 20% strength hydrochloric acid. The precipitated solid was isolated by filtration, washed with water and dried under reduced pressure at 60° C. This gave 17.55 g of the title compound in a purity of about 88% (90% of theory). the mixture was heated at reflux overnight The precipitated solid was isolated by filtration washed with water dried under reduced pressure at 60° C
Source ID: ord-5f6e734295ef42ba8d1e79dd5498b726Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 91 ml of a 3N aqueous sodium hydroxide solution were added to 21.43 g (67.9 mmol) of the compound of Example 1A, and the mixture was heated at reflux overnight. After cooling to RT, the mixture was adjusted to pH 1 by slow addition of about 20% strength hydrochloric acid. The precipitated solid was isolated by filtration, washed with water and dried under reduced pressure at 60° C. This gave 17.55 g of the title compound in a purity of about 88% (90% of theory). the mixture was heated at reflux overnight The precipitated solid was isolated by filtration washed with water dried under reduced pressure at 60° C
Source ID: ord-5f6e734295ef42ba8d1e79dd5498b726Conditions: temp:50.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: A suspension of 12.95 g (75.9 mmol) of 4-chlorobenzohydrazide in 50 ml of dry THF was initially charged at 50° C., and a solution of 10.0 g (77.5 mmol) of ethyl 2-isocyanatoacetate in 100 ml of dry THF was added dropwise. Initially, a solution was formed, and then a precipitate. After the addition had ended, the mixture was stirred at 50° C. for a further 2 h and then allowed to stand at RT overnight. The crystals were isolated by filtration, washed with a little diethyl ether and dried under high vacuum. This gave 21.43 g (89% of theory) of the title compound. was initially charged at 50° C. Initially, a solution was formed After the addition to stand at RT overnight The crystals were isolated by filtration washed with a little diethyl ether dried under high vacuum
Source ID: ord-7f58fe4b59e4497996e582cce58afd88Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 91 ml of a 3N aqueous sodium hydroxide solution were added to 21.43 g (67.93 mmol) of the compound of Example 1A, and the mixture was heated at reflux overnight. After cooling to RT, the mixture was adjusted to pH 1 by slow addition of about 20% strength hydrochloric acid. The precipitated solid was isolated by filtration, washed with water and dried under reduced pressure at 60° C. Yield: 17.55 g (90% of theory, about 88% pure). the mixture was heated at reflux overnight The precipitated solid was isolated by filtration washed with water dried under reduced pressure at 60° C
Source ID: ord-1cb2927fad6842339cd1ddda3b75dc0cConditions: temp:50.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: A suspension of 12.95 g (75.9 mmol) of 4-chlorobenzhydrazide in 50 ml of dry THF was initially charged at 50° C., and a solution of 10.0 g (77.5 mmol) of ethyl 2-isocyanatoacetate in 100 ml of dry THF was added dropwise. Initially, a solution was formed, and then a precipitate. After the addition had ended, the mixture was stirred at 50° C. for a further 2 h and then allowed to stand overnight. The crystals were isolated by filtration, washed with a little diethyl ether and dried under HV. This gave 21.43 g (89% of theory) of the title compound. was initially charged at 50° C. Initially, a solution was formed After the addition to stand overnight The crystals were isolated by filtration washed with a little diethyl ether dried under HV
Source ID: ord-2f45f6e261d24a4ab448a3d8327a22f1Conditions: temp:50.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: A suspension of 12.95 g (75.9 mmol) of 4-chlorobenzhydrazide in 50 ml of dry THF was initially charged at 50° C., and a solution of 10.0 g (77.5 mmol) of ethyl 2-isocyanatoacetate in 100 ml of dry THF was added dropwise. Initially, a solution was formed, and then a precipitate. After the addition had ended, the mixture was stirred at 50° C. for a further 2 h and then allowed to stand overnight. The crystals were isolated by filtration, washed with a little diethyl ether and dried under HV. This gave 21.43 g (89% of theory) of the title compound. was initially charged at 50° C. Initially, a solution was formed After the addition to stand overnight The crystals were isolated by filtration washed with a little diethyl ether dried under HV
Source ID: ord-2f45f6e261d24a4ab448a3d8327a22f1Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: An amount of 21.43 g (67.9 mmol) of the compound from Example 16A was admixed with 91 ml of a 3 N sodium hydroxide solution and heated under reflux overnight. After cooling to RT, the mixture was adjusted to a pH of 1 by slow addition of approximately 20% strength hydrochloric acid. The precipitated solid was isolated by filtration, washed with water and dried at 60° C. under reduced pressure. This gave 17.55 g of the title compound in approximately 88% purity (90% of theory). heated under reflux overnight The precipitated solid was isolated by filtration washed with water dried at 60° C. under reduced pressure
Source ID: ord-00f6ff4b4f85419d9c584a92bf9d2c40PubChem References
These sources are listed in the compound's public database record.
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