4-Iodobenzyl bromide

• CAS: 16004-15-2
• Catalog Number: ACM16004152
• Category: Bromine Series
• Molecular Weight: 296.93
• Hazard Statements: H314-H335
• RIDADR: NONH for all modes of transport
• Symbol: GHS05

Custom Q&A

What is the molecular formula of 4-Iodobenzyl bromide?

The molecular formula of 4-Iodobenzyl bromide is C7H6BrI.

What is the molecular weight of 4-Iodobenzyl bromide?

The molecular weight of 4-Iodobenzyl bromide is 296.93 g/mol.

What are the synonyms for 4-Iodobenzyl bromide?

Some synonyms for 4-Iodobenzyl bromide are 16004-15-2, 1-(bromomethyl)-4-iodobenzene, p-iodobenzyl bromide, and alpha-Bromo-4-iodotoluene.

When was 4-Iodobenzyl bromide first created and last modified?

4-Iodobenzyl bromide was first created on 2005-07-09 and last modified on 2023-12-02.

What is the IUPAC name of 4-Iodobenzyl bromide?

The IUPAC name of 4-Iodobenzyl bromide is 1-(bromomethyl)-4-iodobenzene.

What is the InChI of 4-Iodobenzyl bromide?

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

What is the InChIKey of 4-Iodobenzyl bromide?

The InChIKey of 4-Iodobenzyl bromide is BQTRMYJYYNQQGK-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Iodobenzyl bromide?

The canonical SMILES of 4-Iodobenzyl bromide is C1=CC(=CC=C1CBr)I.

How many hydrogen bond donor counts does 4-Iodobenzyl bromide have?

4-Iodobenzyl bromide has 0 hydrogen bond donor counts.

Is the compound canonicalized for 4-Iodobenzyl bromide?

Yes, the compound is canonicalized for 4-Iodobenzyl bromide.

Synthetic Use

Downstream Synthesis Route 1

• 624-31-7
• 16004-15-2

• 51628-12-7

Reference: [1] Patent: US5589506, 1996, A,

Downstream Synthesis Route 2

• 16004-15-2

• 51628-12-7

Reference: [1] Bioorganic and Medicinal Chemistry Letters, 2014, vol. 24, # 15, p. 3341 - 3345
[2] European Journal of Medicinal Chemistry, 2013, vol. 65, p. 1 - 11
[3] Patent: WO2003/99276, 2003, A1, . Location in patent: Page 366-367

Downstream Synthesis Route 3

• 16004-15-2
• 151-50-8

• 51628-12-7

Reference: [1] Journal of Medicinal Chemistry, 2005, vol. 48, # 5, p. 1336 - 1343
[2] Chemische Berichte, 1878, vol. 11, p. 56

Downstream Synthesis Route 4

• 16004-15-2
• 151-50-8

• 51628-12-7

Reference: [1]Journal of Medicinal Chemistry,2005,vol. 48,p. 1336 - 1343
[2]Chemische Berichte,1878,vol. 11,p. 56

Downstream Synthesis Route 5

• 16004-15-2

• 15164-44-0

Reference: [1]Xu, Wenhao; Su, Weike
[Journal of Chemical Research, 2014, vol. 38, # 12, p. 710 - 714]
[2]Wintersteiner et al.
[Chemistry of Penicillin]
Baker; Hopkins
[Journal of the Chemical Society, 1949, p. 1089,1096]
[3]Shoppee
[Journal of the Chemical Society, 1930, p. 968,979]
[4]Tabata, Masayuki; Moriyama, Katsuhiko; Togo, Hideo
[European Journal of Organic Chemistry, 2014, vol. 2014, # 16, p. 3402 - 3410]

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