3-Iodobenzyl bromide

• CAS: 49617-83-6
• Catalog Number: ACM49617836
• Category: Aryl
• Molecular Weight: 296.93
• Hazard Statements: H302-H314
• RIDADR: UN 3265 8 / PGII
• Symbol: GHS05

Custom Q&A

What is the molecular formula of 3-Iodobenzyl bromide?

The molecular formula of 3-Iodobenzyl bromide is C7H6BrI.

What is the molecular weight of 3-Iodobenzyl bromide?

The molecular weight of 3-Iodobenzyl bromide is 296.93 g/mol.

What is the IUPAC name of 3-Iodobenzyl bromide?

The IUPAC name of 3-Iodobenzyl bromide is 1-(bromomethyl)-3-iodobenzene.

What is the InChI of 3-Iodobenzyl bromide?

The InChI of 3-Iodobenzyl bromide is InChI=1S/C7H6BrI/c8-5-6-2-1-3-7(9)4-6/h1-4H,5H2.

What is the InChIKey of 3-Iodobenzyl bromide?

The InChIKey of 3-Iodobenzyl bromide is BACZSVQZBSCWIG-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Iodobenzyl bromide?

The canonical SMILES of 3-Iodobenzyl bromide is C1=CC(=CC(=C1)I)CBr.

What is the CAS number of 3-Iodobenzyl bromide?

The CAS number of 3-Iodobenzyl bromide is 49617-83-6.

What is the European Community (EC) number of 3-Iodobenzyl bromide?

The European Community (EC) number of 3-Iodobenzyl bromide is 628-893-8.

Is 3-Iodobenzyl bromide a canonicalized compound?

Yes, 3-Iodobenzyl bromide is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 625-95-6

• 49617-83-6

Reference: [1] Advanced Synthesis and Catalysis, 2018, vol. 360, # 21, p. 4197 - 4204

Upstream Synthesis Route 2

• 625-95-6

• 1256294-83-3
• 49617-83-6

Reference: [1] Bioorganic and Medicinal Chemistry, 2009, vol. 17, # 17, p. 6390 - 6401

Upstream Synthesis Route 3

• 506-68-3

• 611-17-6
• 49617-83-6

Reference: [1] Justus Liebigs Annalen der Chemie, 1933, vol. 507, p. 1,9

Upstream Synthesis Route 4

• 625-95-6

• 49617-83-6

Reference: [1]Advanced Synthesis and Catalysis,2018,vol. 360,p. 4197 - 4204

Downstream Synthesis Route 1

• 67344-77-8
• 49617-83-6

• 857825-62-8

Reference: [1]Justus Liebigs Annalen der Chemie,1933,vol. 507,p. 1,9

Downstream Synthesis Route 2

• 1074-82-4
• 49617-83-6

• 200706-60-1

Reference: [1]Patent: CN106187823,2016,A .Location in patent: Paragraph 0026; 0027

* For details of the synthesis route, please refer to the original source to ensure accuracy.