3-Cyano-4-fluorobenzyl bromide

• CAS: 180302-35-6
• Catalog Number: ACM180302356
• Category: Other Products
• Molecular Weight: 214.034
• Molecular Formula: C8H5BrFN
• Synonyms: 5-(bromomethyl)-2-fluorobenzonitrile, 3-cyano-4-fluorobenzyl bromide, 180302-35-6, ZINC02243243, AC1MCNOE, SureCN51855, CTK0E3159, MolPort-001-776-425, ANW-65578, PC6134, SBB094891, AKOS009159497, AB13324, AG-E-30514, AS00642, RP26786, AK-94384, Benzonitrile, 5-(bromomethyl)-2-fluoro-, KB-83263, ALPHA-BROMO-6-FLUORO-M-TOLUNITRILE
• IUPAC Name: 5-(bromomethyl)-2-fluorobenzonitrile
• Canonical SMILES: C1=CC(=C(C=C1CBr)C#N)F
• InChI Key: GUUKPGIJZYZERR-UHFFFAOYSA-N
• Exact Mass: 212.95900
• H-Bond Acceptor: 2
• H-Bond Donor: 0

Synthetic Use

Upstream Synthesis Route 1

• 64113-84-4

• 180302-35-6

Reference: [1] Journal of Medicinal Chemistry, 2016, vol. 59, # 20, p. 9422 - 9430

Upstream Synthesis Route 2

• 227609-85-0

• 180302-35-6

Reference: [1] Organic Preparations and Procedures International, 2000, vol. 32, # 1, p. 88 - 91

Upstream Synthesis Route 3

• 64113-84-4

• 180302-35-6

Reference: [1] Patent: US6265417, 2001, B1,

Upstream Synthesis Route 4

• 64113-84-4

• 180302-35-6

Reference: [1]Journal of Medicinal Chemistry,2016,vol. 59,p. 9422 - 9430

Upstream Synthesis Route 5

• 227609-85-0

• 180302-35-6

Reference: [1]Cain, Gary A.
[Organic Preparations and Procedures International, 2000, vol. 32, # 1, p. 88 - 91]

Downstream Synthesis Route 1

• 180302-35-6

• 368426-87-3

Reference: [1]Cui, Jingrong Jean; Araldi, Gian-Luca; Reiner, John E.; Reddy, Komandla Malla; Kemp, Scott J.; Ho, Jonathan Z.; Siev, Daniel V.; Mamedova, Lala; Gibson, Tony S.; Gaudette, John A.; Minami, Nathaniel K.; Anderson, Susanne M.; Bradbury, Annette E.; Nolan, Thomas G.; Semple
[Bioorganic and Medicinal Chemistry Letters, 2002, vol. 12, # 20, p. 2925 - 2930]

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