ChemicalBook--->CAS DataBase List--->68236-20-4

68236-20-4

68236-20-4 Structure

68236-20-4 Structure
IdentificationBack Directory
[Name]

2-CHLORO-7-METHOXY-QUINOLINE-3-CARBALDEHYDE
[CAS]

68236-20-4
[Synonyms]

AKOS NCG-0061
AKOS BBS-00006540
2-CHLORO-7-METHOXY-3-QUINOLINECARBALDEHYDE
2-Chloro-7-methoxyquinoline-2-carbaldehyde
2-CHLORO-7-METHOXY-QUINOLINE-3-CARBALDEHYDE
2-Chloro-7-methoxyquinoline-3-carboxaldehyde
3-Quinolinecarboxaldehyde,2-chloro-7-methoxy-
2-chloro-7-methoxy-1H-quinoline-2-carboxaldehyde
2-Chloro-3-formyl-7-methoxyquinoline, 2-Chloro-3-formyl-7-methoxy-1-azanaphthalene
[Molecular Formula]

C11H8ClNO2
[MDL Number]

MFCD02227048
[MOL File]

68236-20-4.mol
[Molecular Weight]

221.64
Questions And AnswerBack Directory
[Preparation]

The preparation of 2-CHLORO-7-METHOXY-QUINOLINE-3-CARBALDEHYDE is as follows: N-p-tolylacetamide (2b) (0.05 mol) was dissolved in 9.6 mL of dimethylformamide (0.125 mol), and 32 mL of phosphorus oxychloride (0.35 mol) was gradually added to the solution at 0 °C. The reaction mixture was placed in a round-bottom flask (RBF) equipped with a reflux condenser and a drying tube, and heated in an oil bath at 75-80 °C for 4-16 hours. The solution was then cooled to room temperature and subsequently poured into 100 mL of ice water. The precipitate was collected by filtration and recrystallized from ethyl acetate to give 2-CHLORO-7-METHOXY-QUINOLINE-3-CARBALDEHYDE, yield 75%; MP 122-123℃ (literature 123℃); FT-IR (ATR) ⁻¹ (cm⁻¹): 3051 (aromatic CH), 2873 (aldehyde CH), 1686 (C=O), 1576 (C=N), 1055 (C-Cl); ¹H NMR (400 MHz, chloroform-d): ⁻¹ 0.55 (s, 1H), 8.66 (s, 1H), 7.96 (d, J = 8.5 Hz, 1H), 7.79-7.63 (m, 2H), 2.57 (s, 3H); MS-API: [M+H] + 206.02 (calculated 205.03).
[Application]

2-Chloro-7-methoxy-3-quinoline carbaldehyde can be used as a pharmaceutical synthesis intermediate.
Chemical PropertiesBack Directory
[Melting point ]

196-198°C
[Boiling point ]

373.9±37.0 °C(Predicted)
[density ]

1.348±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

solid
[pka]

-1.00±0.50(Predicted)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H319
[Precautionary statements ]

P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

36-22
[Safety Statements ]

26
[HazardClass ]

IRRITANT
[HS Code ]

2933499090
Spectrum DetailBack Directory
[Spectrum Detail]

2-CHLORO-7-METHOXY-QUINOLINE-3-CARBALDEHYDE(68236-20-4)1HNMR
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