4-Cyano-2-fluorobenzyl bromide

• CAS: 105942-09-4
• Catalog Number: ACM105942094
• Category: Bromine Series

Custom Q&A

What is the molecular formula of 4-Cyano-2-fluorobenzyl bromide?

The molecular formula of 4-Cyano-2-fluorobenzyl bromide is C8H5BrFN.

What is the molecular weight of 4-Cyano-2-fluorobenzyl bromide?

The molecular weight of 4-Cyano-2-fluorobenzyl bromide is 214.03 g/mol.

What is the IUPAC name of 4-Cyano-2-fluorobenzyl bromide?

The IUPAC name of 4-Cyano-2-fluorobenzyl bromide is 4-(bromomethyl)-3-fluorobenzonitrile.

What is the InChI of 4-Cyano-2-fluorobenzyl bromide?

The InChI of 4-Cyano-2-fluorobenzyl bromide is InChI=1S/C8H5BrFN/c9-4-7-2-1-6(5-11)3-8(7)10/h1-3H,4H2.

What is the InChIKey of 4-Cyano-2-fluorobenzyl bromide?

The InChIKey of 4-Cyano-2-fluorobenzyl bromide is ZESZAIOGACKOMB-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Cyano-2-fluorobenzyl bromide?

The canonical SMILES of 4-Cyano-2-fluorobenzyl bromide is C1=CC(=C(C=C1C#N)F)CBr.

What is the CAS number of 4-Cyano-2-fluorobenzyl bromide?

The CAS number of 4-Cyano-2-fluorobenzyl bromide is 105942-09-4.

What is the EC number of 4-Cyano-2-fluorobenzyl bromide?

The EC number of 4-Cyano-2-fluorobenzyl bromide is 675-411-7.

Is 4-Cyano-2-fluorobenzyl bromide a canonicalized compound?

Yes, 4-Cyano-2-fluorobenzyl bromide is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 170572-49-3

• 105942-09-4

Reference: [1] Chemical and Pharmaceutical Bulletin, 2001, vol. 49, # 12, p. 1647 - 1650

Upstream Synthesis Route 2

• 170572-49-3

• 105942-09-4

Reference: [1] Patent: US2009/111858, 2009, A1, . Location in patent: Page/Page column 17

Downstream Synthesis Route 1

• 105942-09-4

• 105942-10-7

Reference: [1] Organic and Biomolecular Chemistry, 2004, vol. 2, # 9, p. 1339 - 1352
[2] Journal of Medicinal Chemistry, 1997, vol. 40, # 13, p. 2064 - 2084

Downstream Synthesis Route 2

• 105942-09-4

• 749838-18-4

Reference: [1]Bioorganic and Medicinal Chemistry Letters,2007,vol. 17,p. 4568 - 4574

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