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Key Documents

Safety Information

542903

Sigma-Aldrich

3-Chloro-4-fluoroiodobenzene

98%

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About This Item

Linear Formula:
ClC6H3(F)I
CAS Number:
Molecular Weight:
256.44
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

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.)

SMILES string

Fc1ccc(I)cc1Cl

InChI

1S/C6H3ClFI/c7-5-3-4(9)1-2-6(5)8/h1-3H

InChI key

OMASDGWBVAVFQZ-UHFFFAOYSA-N

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.

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.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

230.0 °F - closed cup

Flash Point(C)

110 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

542903-BULK:
542903-VAR:
542903-25G:4548173989365


Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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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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