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1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI)

CAS No.
178747-83-6
Chemical Name:
1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI)
Synonyms
4-fluorobenzo[d]isoxazol-3-ol;4-fluoro-1,2-benzoxazol-3-one;4-Fluorobenzisoxazol-3(2H)-one;4-Fluorobenzo[d]isoxazol-3(2H)-one;4-Fluoro-1,2-benzisoxazol-3(2H)-one;1,2-Benzisoxazol-3(2H)-one, 4-fluoro-;1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI)
CBNumber:
CB11272287
Molecular Formula:
C7H4FNO2
Molecular Weight:
153.11
MDL Number:
MFCD18804910
MOL File:
178747-83-6.mol
Last updated:2025-08-08 17:45:00

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI) Properties

Melting point 201-205℃
Density 1.440±0.06 g/cm3 (20℃ 760 Torr)
storage temp. Sealed in dry,Room Temperature
pka 12.98±0.20(Predicted)
Appearance Off-white to light yellow Solid

SAFETY

Risk and Safety Statements

HS Code  2934999090

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI) price More Price(29)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Apolloscientific PC201177 4-Fluorobenzo[d]isoxazol-3(2H)-one >98% 178747-83-6 100mg $21 2026-06-04 Buy
Apolloscientific PC201177 4-Fluorobenzo[d]isoxazol-3(2H)-one >98% 178747-83-6 250mg $25 2026-06-04 Buy
Apolloscientific PC201177 4-Fluorobenzo[d]isoxazol-3(2H)-one >98% 178747-83-6 1g $93 2026-06-04 Buy
Apolloscientific PC201177 4-Fluorobenzo[d]isoxazol-3(2H)-one >98% 178747-83-6 5g $436 2026-06-04 Buy
Apolloscientific PC201177 4-Fluorobenzo[d]isoxazol-3(2H)-one >98% 178747-83-6 25g $1990 2026-06-04 Buy
Product number Packaging Price Buy
PC201177 100mg $21 Buy
PC201177 250mg $25 Buy
PC201177 1g $93 Buy
PC201177 5g $436 Buy
PC201177 25g $1990 Buy

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI) Chemical Properties,Uses,Production

Synthesis

Benzamide, 2-fluoro-N,6-dihydroxy-

855996-64-4

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI)

178747-83-6

The general procedure for the synthesis of 4-fluorophenyl[d]isoxazol-3-one from 2-fluoro-N,6-dihydroxybenzamide is as follows: 1. Add tetrahydrofuran (2.23L) and 1,1'-carbonyl diimidazole (0.910Kg, 5.64mol) to a 20L jacketed reactor and mix with stirring at 20°C. 2. A solution of 2-fluoro-N,6-dihydroxybenzamide (744 g, 4.34 mol) in tetrahydrofuran (4.45 L) was slowly added to the reactor, the temperature was controlled to be lower than 30 °C, and stirring was continued at 25 °C for 30 h. The reaction was carried out at 25 °C with continuous stirring. Gas release was observed during the reaction. 3. The reaction mixture was warmed up to 60°C within 30 minutes and stirring was continued for 6 hours. 4. Upon completion of the reaction, the reactor was cooled to 20 °C and the pH was adjusted to 1 by adding 1N aqueous HCl (7.48 L) within 15 min. 5. set the jacket temperature to 35°C and concentrated the reaction mixture under vacuum to remove about 6.68 L of tetrahydrofuran. 6. The reactor was cooled to 15 °C and stirred for 1 h. A white slurry was obtained by filtration. The filter cake was washed with water (3.71 L) and dried in a vacuum oven at 40°C for 12 hours. 7. The target product 4-fluorobenzo[d]isoxazol-3-ol (597 g, 3.90 mol) was finally isolated in 90% yield. Product characterization data: 1H NMR (400MHz, CD3OD) δ ppm 4.93 (b, 1H), 6.95 (dd, J = 10.1, 8.6, 1H), (d, J = 8.6, 1H), 7.52-7.57 (m, 1H); LRMS 154.029 (m + 1).

References

[1] Patent: WO2011/101774, 2011, A1. Location in patent: Page/Page column 25; 27

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI) Preparation Products And Raw materials

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI) Suppliers

Global( 31)Suppliers
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Allfluoro Pharmaceutical Company Limited +86-400-0216110 +86-15958047586 sales@allfluoro.com China 11380 58

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI) Spectrum

1,2-Benzisoxazol-3(2H)-one,4-fluoro-(9CI) 4-Fluorobenzo[d]isoxazol-3(2H)-one 4-fluorobenzo[d]isoxazol-3-ol 4-Fluoro-1,2-benzisoxazol-3(2H)-one 1,2-Benzisoxazol-3(2H)-one, 4-fluoro- 4-Fluorobenzisoxazol-3(2H)-one 4-fluoro-1,2-benzoxazol-3-one 178747-83-6 HALIDE OXAZOLE