206555

4-Iodotoluene

99%

• Synonym(s): 1-Iodo-4-methylbenzene
• Linear Formula: CH₃C₆H₄I
• CAS Number: 624-31-7
• Molecular Weight: 218.03
• Beilstein/REAXYS Number: 1903637
• EC Number: 210-841-7
• MDL number: MFCD00001059
• UNSPSC Code: 12352100
• PubChem Substance ID: 24852408
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: 99%
• form: solid
• bp: 211.5 °C (lit.)
• mp: 33-35 °C (lit.)
• functional group: iodo
• SMILES string: Cc1ccc(I)cc1
• InChI: 1S/C7H7I/c1-6-2-4-7(8)5-3-6/h2-5H,1H3
• InChI key: UDHAWRUAECEBHC-UHFFFAOYSA-N

Description

General description

4-Iodotoluene undergoes Suzuki-Miyaura coupling reaction with phenylboronic acid catalyzed by (Ni,Mg)₃Si₂O₅(OH)₄ solid-solution nanotubes loaded with palladium. Cobalt-catalyzed coupling of 4-iodotoluene with thiophenols and alkanethiols has been investigated. Palladium/copper-catalyzed Sonogashira cross-coupling reaction of 4-iodotoluene with phenylacetylene has been studied.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302,H315
• pcodes: P264 - P280 - P301 + P312 - P302 + P352 - P332 + P313 - P362 + P364
• Hazard Classifications: Acute Tox. 4 Oral - Skin Irrit. 2
• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: 194.0 °F - closed cup
• flash_point_c: 90 °C - closed cup
• ppe: Eyeshields, Gloves, type N95 (US)