ChemicalBook--->CAS DataBase List--->679840-30-3

679840-30-3

679840-30-3 Structure

679840-30-3 Structure
IdentificationBack Directory
[Name]

1-BROMO-3-(1,3-DIOXOLAN-2-YL)-4-FLUOROBENZENE
[CAS]

679840-30-3
[Synonyms]

RARECHEM AL BP 0325
2-(5-Bromo-2-fluorophenyl)-1,3-dioxolane
1,3-Dioxolane, 2-(5-bromo-2-fluorophenyl)-
1-BROMO-3-(1,3-DIOXOLAN-2-YL)-4-FLUOROBENZENE
[Molecular Formula]

C9H8BrFO2
[MDL Number]

MFCD06209165
[MOL File]

679840-30-3.mol
[Molecular Weight]

247.06
Chemical PropertiesBack Directory
[Boiling point ]

260.0±40.0 °C(Predicted)
[density ]

1.590±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[InChI]

1S/C9H8BrFO2/c10-6-1-2-8(11)7(5-6)9-12-3-4-13-9/h1-2,5,9H,3-4H2
[InChIKey]

WWJNPWYIXIIEJG-UHFFFAOYSA-N
[SMILES]

FC1=CC=C(C=C1C2OCCO2)Br
Questions And AnswerBack Directory
[Uses]

1,1-Diethoxyethylene can be used as a pharmaceutical synthesis intermediate, such as in the preparation of the compound (3-[1,3]dioxolane-2-yl-4-fluoro-phenyl)-(8-nitro-quinoline-7-yl)-methanol. The specific steps are as follows: Magnesium (983 mg, 40.5 mmol) is suspended in anhydrous THF (30 ml). 1,2-Dibromoethane (0.17 ml, 2.02 mmol) is added, and the solution is stirred at room temperature for 20 minutes. 1,1-Diethoxyethylene (3.2 g, 1.295 mmol) is added dropwise, and the mixture is heated at 40 °C for 2 hours. After cooling to room temperature, Grignard reagent (0.43 M; 28.6 ml) is added at 0 °C to the anhydrous THF (30 ml) suspension of 8-nitroquinoline-7-carboxaldehyde 204 (2.5 g, 1.28 mmol).
[Application]

1,1-Diethoxyethylene can be used as a pharmaceutical synthesis intermediate.
Safety DataBack Directory
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
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