[(Fluoromethyl)sulfonyl]benzene

Basic Information

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CAS Number

20808-12-2

Molecular Formula

C7H7FO2S

Molecular Weight

174.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

51.0 to 55.0 deg-C

Boiling Point

314.3℃ at 760 mmHg

SMILES

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C1=CC=C(C=C1)S(=O)(=O)CF

InChI

InChI=1S/C7H7FO2S/c8-6-11(9,10)7-4-2-1-3-5-7/h1-5H,6H2

InChIKey

DENHPZASLKBBHA-UHFFFAOYSA-N

LogP

1.3873

Topological Polar Surface Area

34.14 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

199

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

[(Fluoromethyl)sulfonyl]benzene, AldrichCPR
fluoromethanesulfonylbenzene
phenylsulfonylmethylflouride
DENHPZASLKBBHA-UHFFFAOYSA-N
AS-61794
A814928
Fluoromethylsulfonylbenzene
(fluoromethylsulfonyl)benzene
fluoromethylphenylsulfone
CS-0038264
AKOS005063879
FT-0676296
fluoromethyl-phenyl sulfone
MFCD00191650
Benzene, [(fluoromethyl)sulfonyl]-
F0341
SY018862
SCHEMBL491319
fluoromethanesulfonyl-benzene
Fluoromethyl Phenyl Sulfone
((Fluoromethyl)sulfonyl)benzene
W10728
fluoranylmethylsulfonylbenzene
DTXSID40374616
20808-12-2
fluoromethyl benzene sulfonate
phenylmethylsulfonyl fluoride
Sulfone,fluoromethyl phenyl (8CI)
Phenyl (fluoromethyl) sulfone
Benzene,[(fluoromethyl)sulfonyl]-
Fluoromethyl phenyl sulfone

MDL Number

MFCD00191650

Customs Code

2904909090

FAQ

What are the physical and chemical properties of [(Fluoromethyl)sulfonyl]benzene (CAS: 20808-12-2)?

[(Fluoromethyl)sulfonyl]benzene (CAS: 20808-12-2) is a crystalline solid with a molecular weight of approximately 212.08 g/mol. It has poor water solubility but is highly soluble in organic solvents like dichloromethane and acetonitrile. This compound is reactive towards nucleophiles and can undergo sulfonation reactions. It is used in various synthetic applications due to its unique chemical properties.

How is [(Fluoromethyl)sulfonyl]benzene (CAS: 20808-12-2) typically synthesized?

[(Fluoromethyl)sulfonyl]benzene is typically synthesized through the reaction of benzene with fluoromethylsulfonyl chloride in the presence of a base such as sodium hydroxide. The reaction is carried out in a suitable organic solvent, and the yield and selectivity are influenced by reaction conditions and catalysts like aluminum chloride. This method allows for the formation of the compound with good efficiency.

What industries use [(Fluoromethyl)sulfonyl]benzene (CAS: 20808-12-2)?

[(Fluoromethyl)sulfonyl]benzene (CAS: 20808-12-2) is used in the pharmaceutical industry for the synthesis of certain drugs and in polymer science for developing functional materials. It is also applied in the manufacturing of sensors and semiconductors due to its unique chemical properties and reactivity.

What precautions should be taken when handling [(Fluoromethyl)sulfonyl]benzene (CAS: 20808-12-2)?

When handling [(Fluoromethyl)sulfonyl]benzene (CAS: 20808-12-2), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. This compound should be handled in a well-ventilated area or under a fume hood to minimize exposure. In case of a spill, the area should be cleaned up promptly, and appropriate safety measures should be followed. Always refer to the Safety Data Sheet (SDS) for detailed handling and storage guidelines.