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1,2,3,4-Tetrachloro-5-nitrobenzene(CAS: 879-39-0)

1,2,3,4-Tetrachloro-5-nitrobenzene
CAS Number

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Basic Information

Molecular Formula
C6HCl4NO2
Molecular Weight
260.89 g/mol

Physical Properties

Melting Point
65.0 to 68.0 deg-C
Boiling Point
120.5°C (rough estimate)
Density
1.9820 (rough estimate)
Flash Point
144.4°C

Chemical Identifiers

SMILES
Clc1cc(N(=O)=O)c(c(c1Cl)Cl)Cl
InChIKey
MTBYTWZDRVOMBR-UHFFFAOYSA-N

Database References

MDL Number
MFCD00007064
Beilstein Registry Number
2273256

FAQ

1,2,3,4-Tetrachloro-5-nitrobenzene (CAS: 879-39-0) is a crystalline solid with a molecular weight of approximately 286.01 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and acetone. This compound is moderately reactive, particularly towards nucleophilic substitution and reduction reactions. It decomposes upon heating and is sensitive to light.
1,2,3,4-Tetrachloro-5-nitrobenzene (CAS: 879-39-0) is synthesized through the chlorination of 1-nitrobenzene followed by further chlorination. Commonly, this involves the reaction of 1-nitrobenzene with chlorine gas in the presence of a Lewis acid catalyst like aluminum chloride. The final step involves another chlorination to introduce the fourth chlorine atom.
1,2,3,4-Tetrachloro-5-nitrobenzene (CAS: 879-39-0) is used in the pharmaceutical industry for the synthesis of certain drugs, particularly those requiring chlorinated and nitro functionalities. It is also utilized in the production of chemical intermediates and for the development of sensors and other specialized applications.
When handling 1,2,3,4-Tetrachloro-5-nitrobenzene (CAS: 879-39-0), it is essential to wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated fume hood to minimize exposure to vapors. Spills should be handled with care, using absorbent materials, and the area should be thoroughly cleaned. Refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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