144711

2-(Bromomethyl)benzonitrile

≥97%

• Synonym(s): α-Bromo-o-tolunitrile, 2-Cyanobenzyl bromide
• Linear Formula: BrCH₂C₆H₄CN
• CAS Number: 22115-41-9
• Molecular Weight: 196.04
• Beilstein/REAXYS Number: 742605
• MDL number: MFCD00001794
• UNSPSC Code: 12352100
• PubChem Substance ID: 24848680
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: ≥97%
• form: solid
• mp: 72-74 °C (lit.)
• functional group: bromo; nitrile
• SMILES string: BrCc1ccccc1C#N
• InChI: 1S/C8H6BrN/c9-5-7-3-1-2-4-8(7)6-10/h1-4H,5H2
• InChI key: QGXNHCXKWFNKCG-UHFFFAOYSA-N

Description

General description

2-(Bromomethyl)benzonitrile reacts with 2H-tetrazole in the presence of KOH to yield 4-[(2H-tetra-zol-2-yl)meth-yl]benzonitrile. It undergoes base-promoted condensation reaction with homophthalic anhydride to yield 6,11-dihydro-5H-indeno[1,2-c]isoquinolin-5-one.

Safety Information

• pictograms: GHS05
• signalword: Danger
• hcodes: H314
• pcodes: P260 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363
• Hazard Classifications: Skin Corr. 1B
• Storage Class: 8A - Combustible corrosive hazardous materials
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges