ChemicalBook--->CAS DataBase List--->2547-61-7

2547-61-7

2547-61-7 Structure

2547-61-7 Structure
IdentificationMore
[Name]

Trichloromethanesulfonyl chloride
[CAS]

2547-61-7
[Synonyms]

TRICHLOROMETHANESULFONYL CHLORIDE
Trichlor-methansulfonylchlorid
trichloro-methanesulfonylchlorid
trichloromethanesulphonyl chloride
Trichloromesyl chloride.
TRICHLOROMETHANESULFONYL CHLORIDE, TECH.
[EINECS(EC#)]

219-830-1
[Molecular Formula]

CCl4O2S
[MDL Number]

MFCD00007452
[Molecular Weight]

217.89
[MOL File]

2547-61-7.mol
Chemical PropertiesBack Directory
[Melting point ]

137-140 °C(lit.)
[Boiling point ]

170°C
[density ]

1.8252 (estimate)
[solubility ]

soluble in Toluene
[form ]

solid
[color ]

White to Almost white
[InChI]

1S/CCl4O2S/c2-1(3,4)8(5,6)7
[InChIKey]

ZCPSWAFANXCCOT-UHFFFAOYSA-N
[SMILES]

ClC(Cl)(Cl)S(Cl)(=O)=O
[CAS DataBase Reference]

2547-61-7(CAS DataBase Reference)
[NIST Chemistry Reference]

Methanesulfonyl chloride, trichloro-(2547-61-7)
[EPA Substance Registry System]

2547-61-7(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
R36/37:Irritating to eyes and respiratory system .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 3261 8/PG 2
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HS Code ]

2904.10.5000
[HazardClass ]

8
[PackingGroup ]

III
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1B
STOT SE 3
Questions And AnswerBack Directory
[Application]

Trichloromethanesulfonyl chloride can be used as a pharmaceutical synthesis intermediate. Perfluoroiodoalkanes and bromoalkanes undergo sulfinization-deiodination and debromination reactions with sodium dithionite under appropriate conditions, while perfluorochloroalkanes do not react under similar conditions. However, carbon tetrachloride and 1,1,1-trichloropolyfluoroalkanes can undergo sulfinization-dechlorination reactions with sodium dithionite. Trichlorobromomethane and trichloroiodomethane react under similar conditions to yield sulfinized debromination and deiodination products, respectively.
Hazard InformationBack Directory
[Uses]

Trichloromethanesulfonyl chloride is an efficient free radical chlorinating agent. It reacts with pent-4-enylcobaloximes in inert solvent under tugsten lamp irradiation to yield 2-(β,β,β- trichloroethyl)sulfolanes. It also reacts with trimethylsilyl enol ethers of acetophenones in the presence of a ruthenium (II) phosphine complex to yield 1-aryl-3,3-dichloropropen-1-one and α-chloroacetophenones.
[General Description]

Trichloromethanesulfonyl chloride is an efficient free radical chlorinating agent. It reacts with pent-4-enylcobaloximes in inert solvent under tugsten lamp irradiation to yield 2-(β,β,β- trichloroethyl)sulfolanes. It also reacts with trimethylsilyl enol ethers of acetophenones in the presence of a ruthenium (II) phosphine complex to yield 1-aryl-3,3-dichloropropen-1-one and α-chloroacetophenones.
[Synthesis]

Step 1); reaction at 25°C, under nitrogen atmosphere, 4.0g (26mmol) la, 4.6g (26mmol) sodium thiosulfate, 2.2g sodium bicarbonate, 18mL of water and 6mL of ethyl ether, stirred at 25°C for 6h and then replenished with 2.3g of sodium thiosulfate, 1.1g of s
Spectrum DetailBack Directory
[Spectrum Detail]

Trichloromethanesulfonyl chloride(2547-61-7)MS
Trichloromethanesulfonyl chloride(2547-61-7)13CNMR
Trichloromethanesulfonyl chloride(2547-61-7)IR1
Trichloromethanesulfonyl chloride(2547-61-7)IR2
Trichloromethanesulfonyl chloride(2547-61-7)IR3
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

2547-61-7(sigmaaldrich)
[TCI AMERICA]

Trichloromethanesulfonyl Chloride,>95.0%(T)(2547-61-7)
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