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427691

3-Iodobenzyl bromide

95%

Synonym(s):

α-Bromo-m-iodotoluene, 1-(Bromomethyl)-3-iodobenzene, 3-(Bromomethyl)iodobenzene, m-Iodobenzylbromide

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About This Item

Linear Formula:
IC6H4CH2Br
CAS Number:
49617-83-6
Molecular Weight:
296.93
NACRES:
NA.22
PubChem Substance ID:
24866775
UNSPSC Code:
12352100
MDL number:
MFCD00019016
Assay:
95%
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Quality Segment

assay

95%

mp

46-51 °C (lit.)

functional group

bromo, iodo

SMILES string

BrCc1cccc(I)c1

InChI

1S/C7H6BrI/c8-5-6-2-1-3-7(9)4-6/h1-4H,5H2

InChI key

BACZSVQZBSCWIG-UHFFFAOYSA-N

General description

3-Iodobenzyl bromide (3-IBBr, m-iodobenzyl bromide) is a meta-isomer of iodobenzyl bromide. It can be synthesized by the bromination of m-iodotoluene.

Application

3-Iodobenzyl bromide (3-IBBr, m-iodobenzyl bromide) was used as a derivatization reagent for the extraction and purification of thiouracil (TU).
It may be used in the synthesis of the following:
  • meta-substituted phenylalanine derivatives
  • N6-substituted aristeromycin derivative
  • (N)-methanocarba-N6-(3-iodobenzyl)adenosine

Pictograms

Corrosion
GHS05

Signal Word

Danger

Hazard Codes

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point (°F)

235.4 °F - closed cup

Flash Point (°C)

113 °C - closed cup

PPE (personal protective equipment)

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

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