427691
3-Iodobenzyl bromide
95%
Synonym(s):
α-Bromo-m-iodotoluene, 1-(Bromomethyl)-3-iodobenzene, 3-(Bromomethyl)iodobenzene, m-Iodobenzylbromide
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All Photos(2)
About This Item
Linear Formula:
IC6H4CH2Br
CAS Number:
Molecular Weight:
296.93
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
95%
mp
46-51 °C (lit.)
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
Related Categories
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:
It may be used in the synthesis of the following:
- meta-substituted phenylalanine derivatives
- N6-substituted aristeromycin derivative
- (N)-methanocarba-N6-(3-iodobenzyl)adenosine
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Dam. 1 - Skin Corr. 1B
Storage Class Code
8A - Combustible corrosive hazardous materials
WGK
WGK 3
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Bulletin of the Academy of Sciences of the USSR, Division of chemical science, 22(10), 2251-2254 (1973)
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In recent years, the frequent detection of the banned thyreostat thiouracil (TU) in livestock urine has been related to endogenous TU formation following digestion of glucosinolate-rich Brassicaceae crops. Recently, it was demonstrated that, upon in vitro digestion of Brassicaceae, fecal
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