ChemicalBook--->CAS DataBase List--->7205-98-3

7205-98-3

7205-98-3 Structure

7205-98-3 Structure
IdentificationMore
[Name]

CHLOROMETHYL PHENYL SULFONE
[CAS]

7205-98-3
[Synonyms]

CHLOROMETHYL PHENYL SULFONE
[(CHLOROMETHYL)SULFONYL]BENZENE
PHENYL CHLOROMETHYL SULFONE
[(chloromethyl)sulphonyl]benzene
chloromethyl phenyl sulphone
(Phenylsulfonyl)chloromethane
Phenylsulfonylmethyl chloride
[EINECS(EC#)]

230-581-8
[Molecular Formula]

C7H7ClO2S
[MDL Number]

MFCD00007551
[Molecular Weight]

190.65
[MOL File]

7205-98-3.mol
Chemical PropertiesBack Directory
[Melting point ]

51-53 °C (lit.)
[Boiling point ]

130 °C / 1mmHg
[density ]

1.336±0.06 g/cm3(Predicted)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[color ]

White to Almost white
[BRN ]

2046644
[InChIKey]

NXAIQSVCXQZNRY-UHFFFAOYSA-N
[CAS DataBase Reference]

7205-98-3(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[F ]

21
[HS Code ]

29049095
Hazard InformationBack Directory
[Uses]

Chloromethyl Phenyl Sulfone is used to synthesis of α,β-epoxy sulfones and aziridines; reacts with electrophilic arenes, heterocyclic arenes, and alkenes; source of the α-phenylsulfonylmethyl radical.
[Preparation]

Preparative Methods of Chloromethyl Phenyl Sulfone: several methods are available. The most convenient is the reaction of Sodium Benzenesulfinate dihydrate with bromochloromethane in dimethyl sulfoxide.
[Synthesis]

Thioanisole

100-68-5

Methyl phenyl sulfone

3112-85-4

CHLOROMETHYL PHENYL SULFONE

7205-98-3

The general procedure for the synthesis of phenylmethyl sulfone and chloromethyl phenyl sulfone from methyl phenyl sulfide was as follows: 0.25 g (2 mmol) of methyl phenyl sulfide was used as a substrate and added to a 50 mL three-necked flask along with 10 mL of acetonitrile and 2 mL of water. The internal temperature of the flask was maintained at 23 °C. Subsequently, 0.09 g (4.8 mmol) of sodium hypochlorite pentahydrate crystals were added in portions with continuous stirring. During the reaction, the internal temperature of the flask was increased to 28°C and then gradually decreased. GC analysis was performed 3 h after the start of the reaction and showed that 22% of the methyl phenyl sulfide was converted to methyl phenyl sulfoxide and 65% to methyl phenyl sulfone. By-products included 6% chloromethyl phenyl sulfoxide and 7% chloromethyl phenyl sulfone, and a total of 0.8% advanced chlorides. Addition of 0.79 g (4.8 mmol) of sodium hypochlorite pentahydrate crystals was continued and stirring was continued for 1 hour. At this point, the methyl phenyl sulfide and methyl phenyl sulfoxide completely disappeared and the yield of methyl phenyl sulfone increased to 87%. Impurities included 11% chloromethyl phenyl sulfone, 0.5% dichloromethyl phenyl sulfone and 1.3% trichloromethyl phenyl sulfone.

[Solubility in organics]

Chloromethyl Phenyl Sulfone is soluble in THF, CHCl3, CH2Cl2, and most organic solvents.
[References]

[1] Patent: JP2017/52730, 2017, A. Location in patent: Paragraph 0046
Spectrum DetailBack Directory
[Spectrum Detail]

CHLOROMETHYL PHENYL SULFONE(7205-98-3)MS
CHLOROMETHYL PHENYL SULFONE(7205-98-3)1HNMR
CHLOROMETHYL PHENYL SULFONE(7205-98-3)13CNMR
CHLOROMETHYL PHENYL SULFONE(7205-98-3)IR1
CHLOROMETHYL PHENYL SULFONE(7205-98-3)IR2
CHLOROMETHYL PHENYL SULFONE(7205-98-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

7205-98-3(sigmaaldrich)
[TCI AMERICA]

Chloromethyl Phenyl Sulfone,>97.0%(GC)(7205-98-3)
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