ChemicalBook--->CAS DataBase List--->5057-12-5

5057-12-5

5057-12-5 Structure

5057-12-5 Structure
IdentificationBack Directory
[Name]

4,6,7,8-TETRAHYDRO-1H,3H-QUINOLINE-2,5-DIONE
[CAS]

5057-12-5
[Synonyms]

NSC 160504
Carteolol Impurity 1
Carteolol EP Impurity A
Carteolol Hydrochloride impurity A
3,4,7,8-Tetrahydroquinoline-2,5(1H,6H)
1,3,4,6,7,8-hexahydroquinoline-2,5-quinone
4,6,7,8-TETRAHYDRO-1H,3H-QUINOLINE-2,5-DIONE
4,6,7,8-TETRAHYDRO-2,5(1H,3H)-QUINOLINEDIONE
2,5-Dioxo-1,2,3,4,5,6,7,8-octahydroquinoline
3,4,7,8-Tetrahydroquinoline-2,5(1H,6H)-dione
1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione
4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
4,6,7,8-Tetrahydro-3,4,5,6,7,8-hexahydrocarbostyril-5-one
1,3,4,6,7,8-hexahydroquinoline-2,5-dione(For export only)
[Molecular Formula]

C9H11NO2
[MDL Number]

MFCD01111799
[MOL File]

5057-12-5.mol
[Molecular Weight]

165.19
Chemical PropertiesBack Directory
[Melting point ]

196-198°C
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[color ]

Pale Beige to Beige
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[REACH Registrations]

Active
[HazardClass ]

IRRITANT
[HS Code ]

2933499090
Hazard InformationBack Directory
[Chemical Properties]

Pale Yellow Solid
[Uses]

4,6,7,8-Tetrahydro-2,5(1H,3H)-quinolinedione (cas# 5057-12-5) is a compound useful in organic synthesis.
[Synthesis]

1,3-Cyclohexanedione

504-02-9

Acrylic acid

79-10-7

4,6,7,8-TETRAHYDRO-1H,3H-QUINOLINE-2,5-DIONE

5057-12-5

General method: 1,3-Cyclohexanedione (8.9 mmol, 1 eq.) was mixed with acrylic acid (10.6 mmol, 1.2 eq.) in a reaction vial. Ammonium acetate (10.6 mmol, 1.2 eq.) was then added. The reaction mixture was thoroughly mixed using a spatula and heated with stirring at 80 °C for 5 h under nitrogen protection. After completion of the reaction, it was cooled to room temperature and the reaction mixture was diluted with 10 mL of distilled water followed by two extractions with ethyl acetate (2 × 10 mL). The organic extracts were combined and dried with anhydrous Na2SO4. After filtration, the solvent was removed by evaporation under reduced pressure and the resulting crude product was purified by column chromatography (eluent: ethyl acetate/hexane) to afford the target compound 3,4,7,8-tetrahydroquinoline-2,5(1H,6H)-dione. Characterization data of the compounds are provided.

[References]

[1] Synthetic Communications, 2013, vol. 43, # 22, p. 3010 - 3019
Spectrum DetailBack Directory
[Spectrum Detail]

4,6,7,8-TETRAHYDRO-1H,3H-QUINOLINE-2,5-DIONE(5057-12-5)1HNMR
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