ChemicalBook--->CAS DataBase List--->594-44-5

594-44-5

594-44-5 Structure

594-44-5 Structure
IdentificationMore
[Name]

Ethanesulfonyl chloride
[CAS]

594-44-5
[Synonyms]

ETHANESULFONYL CHLORIDE
ETHANESULPHONYL CHLORIDE
ETHYLSULFONYL CHLORIDE
1-Ethanesulfonyl chloride
1-ethanesulfonylchloride
Ethane sulfochloride
Ethylsulfochloride
ethylsulfurylchloride
TL 77
tl77
ETHANESULFONYL CHLORIDE, 99+%
Ethanesulfonyl chloride, 98+%
1,2-Ethane-disulfonic
Ethane-1-sulfonic acid chloride
Ethanesulfonic acid chloride
Ethyl sulfone chloride
[EINECS(EC#)]

209-842-5
[Molecular Formula]

C2H5ClO2S
[MDL Number]

MFCD00007460
[Molecular Weight]

128.58
[MOL File]

594-44-5.mol
Chemical PropertiesBack Directory
[Appearance]

clear light brownish to pinkish-purple liquid
[Melting point ]

-70°C
[Boiling point ]

177 °C (lit.)
[density ]

1.357 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.452(lit.)
[Fp ]

182 °F
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

soluble in dichloromethane,Ether
[form ]

Liquid
[color ]

Clear colorless to light yellow or light brownish to pinkish-purple
[Water Solubility ]

DECOMPOSES
[Sensitive ]

Moisture Sensitive
[BRN ]

773865
[InChI]

1S/C2H5ClO2S/c1-2-6(3,4)5/h2H2,1H3
[InChIKey]

FRYHCSODNHYDPU-UHFFFAOYSA-N
[SMILES]

CCS(Cl)(=O)=O
[CAS DataBase Reference]

594-44-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Ethanesulfonyl chloride(594-44-5)
[EPA Substance Registry System]

594-44-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Skull and Crossbones (GHS06)
GHS05,GHS06
[Signal word ]

Danger
[Hazard statements ]

H302+H312-H314-H330-H335
[Precautionary statements ]

P260-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
[Hazard Codes ]

T
[Risk Statements ]

R21/22:Harmful in contact with skin and if swallowed .
R23:Toxic by inhalation.
R34:Causes burns.
R22:Harmful if swallowed.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
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 2927 6.1/PG 2
[WGK Germany ]

3
[RTECS ]

KI8050000
[F ]

19-21
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

6.1
[PackingGroup ]

II
[HS Code ]

29049090
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 2 Inhalation
Acute Tox. 4 Dermal
Acute Tox. 4 Oral
Eye Dam. 1
Skin Corr. 1B
STOT SE 3
[Hazardous Substances Data]

594-44-5(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethylthiocyanate
[Preparation Products]

1-Ethylsulfonyl-piperazine-->Methyl ethanesulfonate-->Ethanesulfonamide-->ABBV-075-->Ethylicin-->Methyl 4-ethanesulfonaMidobenzoate-->2-(1-(ethylsulfonyl)azetidin-3-ylidene)acetonitrile-->2-(1-(ethylsulfonyl)-3-(4-(7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)azetidin-3-yl)acetonitrile-->4-[(Ethylsulfonyl)amino]benzoic acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Ethanesulfonyl chloride(594-44-5).msds
Hazard InformationBack Directory
[Chemical Properties]

clear light brownish to pinkish-purple liquid
[Uses]

Chloroethylsulfone was used in discovery of a selective inhibitor of oncogenic B-raf kinase with potent antimelanoma activity.
[Application]

Ethanesulfonyl chloride can make sulfonyl-substituted imides, methide lithium salts, and pentafluoroethanesulfonyl fluoride, a fluorinated surfactant. It is an intermediate in synthesizing new, low-cost, non-fluorinated, sulfonyl-substituted imide and methide lithium salts and an intermediate in preparing the fluorinated surfactant pentafluoroethanesulfonyl fluoride.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 61, p. 2548, 1939 DOI: 10.1021/ja01878a085
[Hazard]

Ethanesulphonyl chloride is harmful to humans; it is corrosive, irritant and acutely toxic. Contact may cause severe skin burns and eye damage, whilst inhalation may cause respiratory irritation and, in severe cases, may be fatal.
Spectrum DetailBack Directory
[Spectrum Detail]

Ethanesulfonyl chloride(594-44-5)MS
Ethanesulfonyl chloride(594-44-5)1HNMR
Ethanesulfonyl chloride(594-44-5)IR1
Ethanesulfonyl chloride(594-44-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Ethanesulfonyl chloride, 98+%(594-44-5)
[Alfa Aesar]

Ethanesulfonyl chloride, 98+%(594-44-5)
[Sigma Aldrich]

594-44-5(sigmaaldrich)
[TCI AMERICA]

Ethanesulfonyl Chloride,>98.0%(T)(594-44-5)
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