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ChemicalBook >> CAS DataBase List >>7-Bromo-2,3-dihydro-isoindol-1-one

7-Bromo-2,3-dihydro-isoindol-1-one

CAS No.
200049-46-3
Chemical Name:
7-Bromo-2,3-dihydro-isoindol-1-one
Synonyms
7-Bromo-1-isoindolinone;7-Bromo-2,3-dihydro-isoindol-1-one;7-bromo-2,3-dihydro-isoindole-1-one;7-broMo-2,3-dihydro-1H-isoindol-1-one;1H-Isoindol-1-one, 7-broMo-2,3-dihydro-
CBNumber:
CB41874736
Molecular Formula:
C8H6BrNO
Molecular Weight:
212.04
MDL Number:
MFCD11848600
MOL File:
200049-46-3.mol
MSDS File:
SDS
Last updated:2026-05-28 02:02:00
Product description Number Pack Size Price
7-Bromo-2,3-dihydro-1H-isoindol-1-one 97% AS59665 1g $59
7-Bromo-2,3-dihydro-1H-isoindol-1-one 97% AS59665 5g $271
7-Bromo-2,3-dihydro-1H-isoindol-1-one 95% OR305302 250mg $24
7-Bromo-2,3-dihydro-1H-isoindol-1-one 97% AS59665 25g $1178
7-Bromo-2,3-dihydro-1H-isoindol-1-one 95% OR305302 1g $83
More product size

7-Bromo-2,3-dihydro-isoindol-1-one Properties

Boiling point 452.2±45.0 °C(Predicted)
Density 1.666±0.06 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
pka 13.36±0.20(Predicted)
form powder
color Off-white
InChI InChI=1S/C8H6BrNO/c9-6-3-1-2-5-4-10-8(11)7(5)6/h1-3H,4H2,(H,10,11)
InChIKey XTWPGJGLJLJZHW-UHFFFAOYSA-N
SMILES C1(=O)C2=C(C=CC=C2Br)CN1

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P280-P362+P364
HS Code  2925199590

7-Bromo-2,3-dihydro-isoindol-1-one price More Price(56)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Activate Scientific AS59665 7-Bromo-2,3-dihydro-1H-isoindol-1-one 97% 200049-46-3 1g $59 2026-06-04 Buy
Activate Scientific AS59665 7-Bromo-2,3-dihydro-1H-isoindol-1-one 97% 200049-46-3 5g $271 2026-06-04 Buy
Apolloscientific OR305302 7-Bromo-2,3-dihydro-1H-isoindol-1-one 95% 200049-46-3 250mg $24 2026-06-04 Buy
Activate Scientific AS59665 7-Bromo-2,3-dihydro-1H-isoindol-1-one 97% 200049-46-3 25g $1178 2026-06-04 Buy
Apolloscientific OR305302 7-Bromo-2,3-dihydro-1H-isoindol-1-one 95% 200049-46-3 1g $83 2026-06-04 Buy
Product number Packaging Price Buy
AS59665 1g $59 Buy
AS59665 5g $271 Buy
OR305302 250mg $24 Buy
AS59665 25g $1178 Buy
OR305302 1g $83 Buy

7-Bromo-2,3-dihydro-isoindol-1-one Chemical Properties,Uses,Production

Uses

7-Bromo-2,3-dihydro-isoindole-1-one is a useful research chemical for organic synthesis and other chemical processes.

Synthesis

Methyl 2-bromo-6-methylbenzoate

99548-56-8

7-Bromo-2,3-dihydro-isoindol-1-one

200049-46-3

General procedure for the synthesis of 7-bromo-2,3-dihydro-isoindol-1-one from methyl 2-bromo-6-methylbenzoate: methyl 2-bromo-6-methylbenzoate (65.9 g, 288 mmol), N-bromosuccinimide (NBS, 53.8 g, 302 mmol), and azobisisobutyronitrile (AIBN, 2.3 g, 14 mmol) were dissolved in benzene ( 1 L) in benzene and heated to reflux for 8 hours. After completion of the reaction, the mixture was cooled to 25 °C, the succinimide was removed by filtration and the filter cake was washed with hexane. The filtrate was concentrated and dissolved in tetrahydrofuran (THF, 1 L), concentrated ammonia (NH4OH, 290 mL) was added, and stirred at 25 °C for 4 hours. The reaction solution was diluted with water (1 L) and extracted with ethyl acetate (EtOAc, 3 x 300 mL). The organic phases were combined, concentrated and purified by silica gel column chromatography (SiO2) to afford 7-bromo-2,3-dihydro-isoindol-1-one (28.9 g, 47% yield) as an off-white solid. 1H NMR (400 MHz, CDCl3) δ 7.73 (br s, 1H), 7.62 (d, J = 7.2 Hz, 1H), 7.43 (m, 2H),. 4.42 (s, 2H); mass spectrum (ESI) m/z: not detected (MH+).

References

[1] Patent: WO2007/47646, 2007, A2. Location in patent: Page/Page column 52-53
[2] Heterocycles, 1997, vol. 45, # 11, p. 2217 - 2221

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7-Bromo-2,3-dihydro-isoindol-1-one Spectrum

7-Bromo-2,3-dihydro-isoindol-1-one 1H-Isoindol-1-one, 7-broMo-2,3-dihydro- 7-broMo-2,3-dihydro-1H-isoindol-1-one 7-Bromo-1-isoindolinone 7-bromo-2,3-dihydro-isoindole-1-one 200049-46-3 Pharmaceutical intermediate
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