5798-79-8 | Bromobenzyl cyanide

Availability
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Description

• Catalog Number: AG77013
• Chemical Name: Bromobenzyl cyanide
• CAS Number: 5798-79-8
• Molecular Formula: C8H6BrN
• Molecular Weight: 196.0439
• MDL Number: MFCD01672925
• SMILES: BrC(c1ccccc1)C#N

Computed Properties

• Complexity: 141
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Undefined Atom Stereocenter Count: 1
• XLogP3: 2.5

Literature

• Analogues of morphanthridine and the tear gas dibenz[b,f][1,4]oxazepine (CR) as extremely potent activators of the human transient receptor potential ankyrin 1 (TRPA1) channel.

  Journal of medicinal chemistry 20101014

• Transient receptor potential ankyrin 1 (TRPA1) channel as emerging target for novel analgesics and anti-inflammatory agents.

  Journal of medicinal chemistry 20100722