427691

3-Iodobenzyl bromide

95%

• Synonym(s): α-Bromo-m-iodotoluene, 1-(Bromomethyl)-3-iodobenzene, 3-(Bromomethyl)iodobenzene, m-Iodobenzylbromide
• Linear Formula: IC₆H₄CH₂Br
• CAS Number: 49617-83-6
• Molecular Weight: 296.93
• MDL number: MFCD00019016
• UNSPSC Code: 12352100
• PubChem Substance ID: 24866775
• NACRES: NA.22

Properties

• Quality Level: 100
• 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

Description

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

Safety Information

• Pictograms: GHS05
• Signal Word: Danger
• Hazard Statements: H314
• Precautionary Statements: P260 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363
• 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