3-(Bromomethyl)benzo[b]thiophene

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3-(Bromomethyl)benzo[b]thiophene Basic information
Product Name:3-(Bromomethyl)benzo[b]thiophene
Synonyms:3-(Bromomethyl)benzo[b]thiophene;3-(Bromomethyl)-1-benzothiophene;3-(Bromomethyl)benzothiophene;Benzo[b]thiophene, 3-(bromomethyl)-
CAS:1196-19-6
MF:C9H7BrS
MW:227.12
EINECS:
Product Categories:
Mol File:1196-19-6.mol
3-(Bromomethyl)benzo[b]thiophene Structure
3-(Bromomethyl)benzo[b]thiophene Chemical Properties
Boiling point 311.3±17.0 °C(Predicted)
density 1.593±0.06 g/cm3(Predicted)
storage temp. Inert atmosphere,Store in freezer, under -20°C
form solid
InChI1S/C9H7BrS/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6H,5H2
InChIKeyWYKHJZSILIVQKU-UHFFFAOYSA-N
SMILESBrCC1=CSC2=C1C=CC=C2
Safety Information
HS Code 2934208090
Storage Class11 - Combustible Solids
Hazard ClassificationsAcute Tox. 4 Oral
MSDS Information
3-(Bromomethyl)benzo[b]thiophene Usage And Synthesis
Synthesis
3-Hydroxymetnylbenzo[b]thiophene

5381-24-8

3-(Bromomethyl)benzo[b]thiophene

1196-19-6

B. Phosphorus tribromide (PBr3, 0.23 mL, 2.42 mmol) was added slowly and dropwise to a stirring solution of benzothiophene-3-ylmethanol (400 mg, 2.44 mmol) in ether (12 mL) at 0 °C. The reaction mixture was continued to be stirred at 0 °C for 30 min, then brought to room temperature and held for 45 min. The reaction mixture was poured into a mixture of ice water and ether, and the organic phase was separated, washed with saturated brine, dried over anhydrous sodium sulfate, and concentrated under reduced pressure to afford 3-(bromomethyl)benzo[b]thiophene as a light-colored solid (404 mg, 73% yield).

References[1] Patent: WO2008/110793, 2008, A1. Location in patent: Page/Page column 111
[2] Patent: US2009/176996, 2009, A1. Location in patent: Page/Page column 15-16
3-(Bromomethyl)benzo[b]thiophene Preparation Products And Raw materials
Raw materials1-Benzothiophene-3-carbaldehyde-->3-Hydroxymetnylbenzo[b]thiophene-->Phosphorus tribromide-->Diethyl ether
Tag:3-(Bromomethyl)benzo[b]thiophene(1196-19-6) Related Product Information
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