552453
2-Fluoro-5-iodobenzonitrile
97%
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About This Item
Linear Formula:
C6H3FICN
CAS Number:
Molecular Weight:
247.01
UNSPSC Code:
12352100
PubChem Substance ID:
MDL number:
Assay:
97%
Form:
solid
assay
97%
form
solid
mp
72-76 °C (lit.)
SMILES string
Fc1ccc(I)cc1C#N
InChI
1S/C7H3FIN/c8-7-2-1-6(9)3-5(7)4-10/h1-3H
InChI key
BIZHQRAAZMDWNK-UHFFFAOYSA-N
General description
2-Fluoro-5-iodobenzonitrile is a halogenated benzonitrile. It participates in the preparation of 4-phenoxy benzamide riboside, a key intermediate formed during the chemical synthesis of 4-phenoxybenzamide adenine dinucleotide.
Application
2-Fluoro-5-iodobenzonitrile may be used in the synthesis of 5-substituted-3-amino indazoles and 5-iodo-1-methyl-1H-indazol-3-amine.
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Synthesis of 4-phenoxybenzamide adenine dinucleotide as NAD analogue with inhibitory activity against enoyl-ACP reductase (InhA) of Mycobacterium tuberculosis.
Bonnac L, et al.
Bioorganic & Medicinal Chemistry Letters, 17(16), 4588-4591 (2007)
Scaffold oriented synthesis. Part 3: design, synthesis and biological evaluation of novel 5-substituted indazoles as potent and selective kinase inhibitors employing [2+ 3] cycloadditions.
Akritopoulou-Zanze I, et al.
Bioorganic & Medicinal Chemistry Letters, 21(5), 1476-1479 (2011)
A method for the regioselective synthesis of 1-alkyl-1H-indazoles.
Liu HJ, et al.
Tetrahedron, 69(19), 3907-3912 (2013)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 552453-5G | 04061832100883 |
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