ChemicalBook--->CAS DataBase List--->542-81-4

542-81-4

542-81-4 Structure

542-81-4 Structure
IdentificationMore
[Name]

2-CHLOROETHYL METHYL SULFIDE
[CAS]

542-81-4
[Synonyms]

2-CHLOROETHYL METHYL SULFIDE
2-CHLOROETHYLMETHYLSULPHIDE
2-(METHYLTHIO)ETHYL CHLORIDE
B-CHLOROETHYL METHYL SULFIDE
BETA-CHLOROETHYL METHYL SULFIDE
HEMISULFUR MUSTARD
1-Chloro-2-(methylsulfanyl)ethane
1-Chloro-2-(methylthio)ethane
1-chloro-2-methylsulfanyl-ethane
Ethane, 1-chloro-2-(methylthio)-
Ethane,1-chloro-2-(methylthio)-
Sulfide, 2-chloroethyl methyl
BETA-CHLORO-ETHYL-METHYLSULPHIDE
2-chloromethyl methyl sulfide
2-(Methylthio)ethyl chloride, Hemisulfur mustard
Methyl 2-chloroethyl sulfide
Methyl(2-chloroethyl) sulfide
[EINECS(EC#)]

208-828-6
[Molecular Formula]

C3H7ClS
[MDL Number]

MFCD00000978
[Molecular Weight]

110.61
[MOL File]

542-81-4.mol
Chemical PropertiesBack Directory
[Boiling point ]

55-56 °C/30 mmHg (lit.)
[density ]

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

n20/D 1.496(lit.)
[Fp ]

108 °F
[storage temp. ]

2-8°C
[form ]

clear liquid
[color ]

Colorless to Light yellow to Light orange
[Specific Gravity]

1.12
[BRN ]

1731033
[InChI]

InChI=1S/C3H7ClS/c1-5-3-2-4/h2-3H2,1H3
[InChIKey]

MYFKLQFBFSHBPA-UHFFFAOYSA-N
[SMILES]

C(Cl)CSC
[CAS DataBase Reference]

542-81-4(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R10:Flammable.
R20/22:Harmful by inhalation and if swallowed .
R34:Causes burns.
[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 2924 3/PG 3
[WGK Germany ]

3
[F ]

10-13
[HS Code ]

2930.90.9250
[HazardClass ]

3.2
[PackingGroup ]

III
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Carc. 1A
Flam. Liq. 3
Skin Corr. 1B
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Thionyl chloride-->Methylthioethane
[Preparation Products]

2-(Methylthio)ethanol
Hazard InformationBack Directory
[Uses]

2-Chloroethyl methyl sulfide is a monofunctional chemical analog of sulfur mustard and has been used to study the potential of 2,6-dithiopurine as an antagonist of sulfur mustard.
Spectrum DetailBack Directory
[Spectrum Detail]

2-CHLOROETHYL METHYL SULFIDE(542-81-4)MS
2-CHLOROETHYL METHYL SULFIDE(542-81-4)1HNMR
2-CHLOROETHYL METHYL SULFIDE(542-81-4)13CNMR
2-CHLOROETHYL METHYL SULFIDE(542-81-4)IR1
2-CHLOROETHYL METHYL SULFIDE(542-81-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

542-81-4(sigmaaldrich)
[TCI AMERICA]

2-Chloroethyl Methyl Sulfide,>97.0%(GC)(542-81-4)
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