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About This Item
Linear Formula:
ClC6H3(F)I
CAS Number:
Molecular Weight:
256.44
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Product Name
3-Chloro-4-fluoroiodobenzene, 98%
InChI
1S/C6H3ClFI/c7-5-3-4(9)1-2-6(5)8/h1-3H
SMILES string
Fc1ccc(I)cc1Cl
InChI key
OMASDGWBVAVFQZ-UHFFFAOYSA-N
assay
98%
refractive index
n20/D 1.604 (lit.)
bp
94-95 °C/15 mmHg (lit.)
density
2.008 g/mL at 25 °C (lit.)
functional group
chloro
fluoro
iodo
Quality Level
Application
3-Chloro-4-fluoroiodobenzene may be used in the preparation of 2-chloro-1-(3,5-dimethoxyphenoxy)-4-iodobenzene by reacting with 3,5-dimethoxyphenol in the presence of cesium carbonate.
General description
3-Chloro-4-fluoroiodobenzene, also known as 2-chloro-1-fluoro-4-iodobenzene [IUPAC name], is a polyhalobenzene. It participates in the synthesis of 3-carboxythiophene analogs.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
230.0 °F - closed cup
flash_point_c
110 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Selectivity issues in the catalytic multiphase reduction of functionalized halogenated aromatics over Pd/C, Pt/C, and Raney-Ni
Evdokimova, Galina, et al.
Applied Catalysis A: General, 271.1, 129-136 (2004)
Fused thiophene derivatives as MEK inhibitors
Laing VE, et al.
Bioorganic & Medicinal Chemistry Letters, 22.1 , 472-475 (2012)
Synthesis of Phloroglucinol Monoaryl Ethers
Sherwood AM, et al.
Synthesis, 44.08, 1208-1212 (2012)
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